N-[(2S)-2-cyano-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethylidene]thiophene-2-sulfonamide

Systemtic Name: N-[(2S)-2-cyano-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethylidene]thiophene-2-sulfonamide Openeye Name: N-[(2S)-2-cyano-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethylidene]thiophene-2-sulfonamide CAS Name: N-[(2S)-2-cyano-2-(1-methyl-2-benzimidazolyl)-1-phenylethylidene]-2-thiophenesulfonamide IUPAC Name: N-[(2S)-2-cyano-2-(1-methylbenzimidazol-2-yl)-1-phenylethylidene]thiophene-2-sulfonamide Traditional Name: N-[(2S)-2-cyano-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethylidene]thiophene-2-sulfonamide Formula: C21H16N4O2S2 MolecularWeight: 420.50734

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C#N)C(=NS(=O)(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@H](C#N)C(=NS(=O)(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N4O2S2/c1-25-18-11-6-5-10-17(18)23-21(25)16(14-22)20(15-8-3-2-4-9-15)24-29(26,27)19-12-7-13-28-19/h2-13,16H,1H3/t16-/m1/s1