6,7-dimethoxy-3-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-3-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 3-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-6,7-dimethoxy-quinazolin-4-one CAS Name: 6,7-dimethoxy-3-[3-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-6,7-dimethoxyquinazolin-4-one Traditional Name: 3-[3-(4-benzylpiperazino)-3-keto-propyl]-6,7-dimethoxy-quinazolin-4-one Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C24H28N4O4/c1-31-21-14-19-20(15-22(21)32-2)25-17-28(24(19)30)9-8-23(29)27-12-10-26(11-13-27)16-18-6-4-3-5-7-18/h3-7,14-15,17H,8-13,16H2,1-2H3