[3-methyl-4-(3-methylphenyl)piperazin-1-yl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone

Systemtic Name: [3-methyl-4-(3-methylphenyl)piperazin-1-yl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone Openeye Name: [3-methyl-4-(m-tolyl)piperazin-1-yl]-(6-thioxo-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone CAS Name: [3-methyl-4-(3-methylphenyl)-1-piperazinyl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone IUPAC Name: [3-methyl-4-(3-methylphenyl)piperazin-1-yl]-(6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone Traditional Name: [3-methyl-4-(m-tolyl)piperazino]-(6-thioxo-5H-benzimidazolo[1,2-c]quinazolin-3-yl)methanone Formula: C27H25N5OS MolecularWeight: 467.5853

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=CC4=C(C=C3)C5=NC6=CC=CC=C6N5C(=S)N4

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=CC4=C(C=C3)C5=NC6=CC=CC=C6N5C(=S)N4

InChI

InChI=1S/C27H25N5OS/c1-17-6-5-7-20(14-17)31-13-12-30(16-18(31)2)26(33)19-10-11-21-23(15-19)29-27(34)32-24-9-4-3-8-22(24)28-25(21)32/h3-11,14-15,18H,12-13,16H2,1-2H3,(H,29,34)