7,8-diethoxy-6-[4-[3-(4-methylpiperazin-1-yl)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7,8-diethoxy-6-[4-[3-(4-methylpiperazin-1-yl)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7,8-diethoxy-6-[4-[3-(4-methylpiperazin-1-yl)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7,8-diethoxy-6-[4-[3-(4-methyl-1-piperazinyl)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7,8-diethoxy-6-[4-[3-(4-methylpiperazin-1-yl)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7,8-diethoxy-6-[4-[3-(4-methylpiperazino)propyl]phenyl]-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C2C=NCC(=O)NC2=C1)C3=CC=C(C=C3)CCCN4CCN(CC4)C)OCC

Isomeric SMILES

CCOC1=C(C(=C2C=NCC(=O)NC2=C1)C3=CC=C(C=C3)CCCN4CCN(CC4)C)OCC

InChI

InChI=1S/C27H36N4O3/c1-4-33-24-17-23-22(18-28-19-25(32)29-23)26(27(24)34-5-2)21-10-8-20(9-11-21)7-6-12-31-15-13-30(3)14-16-31/h8-11,17-18H,4-7,12-16,19H2,1-3H3,(H,29,32)