2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-methyl-indole-3-carbonitrile

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-methyl-indole-3-carbonitrile Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-methyl-indole-3-carbonitrile CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-1-methyl-3-indolecarbonitrile IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-1-methylindole-3-carbonitrile Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-1-methyl-indole-3-carbonitrile Formula: C18H14N4S MolecularWeight: 318.39556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1CSC3=NC4=CC=CC=C4N3)C#N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1CSC3=NC4=CC=CC=C4N3)C#N

InChI

InChI=1S/C18H14N4S/c1-22-16-9-5-2-6-12(16)13(10-19)17(22)11-23-18-20-14-7-3-4-8-15(14)21-18/h2-9H,11H2,1H3,(H,20,21)