N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(2-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(2-methylphenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-(o-tolyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-(2-methylphenyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-(2-methylphenyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-1,3-diketo-2-(o-tolyl)isoindoline-5-carboxamide Formula: C27H24N4O3S MolecularWeight: 484.56946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC(CCSC)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC(CCSC)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H24N4O3S/c1-16-7-3-6-10-23(16)31-26(33)18-12-11-17(15-19(18)27(31)34)25(32)30-22(13-14-35-2)24-28-20-8-4-5-9-21(20)29-24/h3-12,15,22H,13-14H2,1-2H3,(H,28,29)(H,30,32)