6,7-bis(aziridin-1-yl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione

Systemtic Name: 6,7-bis(aziridin-1-yl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione Openeye Name: 6,7-bis(aziridin-1-yl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione CAS Name: 6,7-bis(1-aziridinyl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione IUPAC Name: 6,7-bis(aziridin-1-yl)-4-[3-(dimethylamino)propylamino]quinazoline-5,8-dione Traditional Name: 4-[3-(dimethylamino)propylamino]-6,7-diethylenimino-quinazoline-5,8-quinone Formula: C17H22N6O2 MolecularWeight: 342.39558

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC=NC2=C1C(=O)C(=C(C2=O)N3CC3)N4CC4

Isomeric SMILES

CN(C)CCCNC1=NC=NC2=C1C(=O)C(=C(C2=O)N3CC3)N4CC4

InChI

InChI=1S/C17H22N6O2/c1-21(2)5-3-4-18-17-11-12(19-10-20-17)16(25)14(23-8-9-23)13(15(11)24)22-6-7-22/h10H,3-9H2,1-2H3,(H,18,19,20)