Chemistry:Carboquone

Carboquone
Clinical data
ATC code	L01AC03 (WHO) ;
Identifiers
	IUPAC name {2-[2,5-bis(aziridin-1-yl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]-2-methoxyethyl} carbamate;
CAS Number	24279-91-2;
PubChem CID	2569;
ChemSpider	2471;
UNII	1CB0HBT12C;
ChEMBL	ChEMBL443014;
Chemical and physical data
Formula	C15H19N3O5
Molar mass	321.333 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES O=C(OCC(OC)C=1C(=O)\C(=C(/C(=O)C=1N2CC2)C)N3CC3)N;
	InChI InChI=1S/C15H19N3O5/c1-8-11(17-3-4-17)14(20)10(9(22-2)7-23-15(16)21)12(13(8)19)18-5-6-18/h9H,3-7H2,1-2H3,(H2,16,21); Key:SHHKQEUPHAENFK-UHFFFAOYSA-N;
	(verify)

Short description: Chemical compound

Carboquone is a drug used in chemotherapy.^[1]

References

↑ "[An anticancer drug--carboquone]" (in Japanese). Gan to Kagaku Ryoho. Cancer & Chemotherapy 15 (3): 549–54. March 1988. PMID 3279914.

Clinical data

ATC code	L01AC03 (WHO)
Identifiers
IUPAC name {2-[2,5-bis(aziridin-1-yl)-4-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl]-2-methoxyethyl} carbamate
CAS Number	24279-91-2
PubChem CID	2569
ChemSpider	2471
UNII	1CB0HBT12C
ChEMBL	ChEMBL443014
Chemical and physical data
Formula	C₁₅H₁₉N₃O₅
Molar mass	321.333 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES O=C(OCC(OC)C=1C(=O)\C(=C(/C(=O)C=1N2CC2)C)N3CC3)N
InChI InChI=1S/C15H19N3O5/c1-8-11(17-3-4-17)14(20)10(9(22-2)7-23-15(16)21)12(13(8)19)18-5-6-18/h9H,3-7H2,1-2H3,(H2,16,21) Key:SHHKQEUPHAENFK-UHFFFAOYSA-N
(verify)