3-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-6,7-dimethoxy-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[3-(4-benzhydrylpiperazino)propyl]-6,7-dimethoxy-2-thioxo-1H-quinazolin-4-one Formula: C30H34N4O3S MolecularWeight: 530.68096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)OC

InChI

InChI=1S/C30H34N4O3S/c1-36-26-20-24-25(21-27(26)37-2)31-30(38)34(29(24)35)15-9-14-32-16-18-33(19-17-32)28(22-10-5-3-6-11-22)23-12-7-4-8-13-23/h3-8,10-13,20-21,28H,9,14-19H2,1-2H3,(H,31,38)