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

Systemtic Name: 6-(dimethylamino)-3-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-6-(dimethylamino)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-(dimethylamino)-3-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[3-(4-benzhydrylpiperazin-1-yl)propyl]-6-(dimethylamino)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[3-(4-benzhydrylpiperazino)propyl]-6-(dimethylamino)-2-thioxo-1H-quinazolin-4-one Formula: C30H35N5OS MolecularWeight: 513.6968

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)NC(=S)N(C2=O)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)NC(=S)N(C2=O)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N5OS/c1-32(2)25-14-15-27-26(22-25)29(36)35(30(37)31-27)17-9-16-33-18-20-34(21-19-33)28(23-10-5-3-6-11-23)24-12-7-4-8-13-24/h3-8,10-15,22,28H,9,16-21H2,1-2H3,(H,31,37)