(4R)-2-(1H-benzimidazol-2-yl)-3-oxidanylidene-4-phenyl-4-phenylsulfanyl-butanenitrile

Systemtic Name: (4R)-2-(1H-benzimidazol-2-yl)-3-oxidanylidene-4-phenyl-4-phenylsulfanyl-butanenitrile Openeye Name: (4R)-2-(1H-benzimidazol-2-yl)-3-oxo-4-phenyl-4-phenylsulfanyl-butanenitrile CAS Name: (4R)-2-(1H-benzimidazol-2-yl)-3-oxo-4-phenyl-4-(phenylthio)butanenitrile IUPAC Name: (4R)-2-(1H-benzimidazol-2-yl)-3-oxo-4-phenyl-4-phenylsulfanylbutanenitrile Traditional Name: (4R)-2-(1H-benzimidazol-2-yl)-3-keto-4-phenyl-4-(phenylthio)butyronitrile Formula: C23H17N3OS MolecularWeight: 383.46558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C(C#N)C2=NC3=CC=CC=C3N2)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)C(C#N)C2=NC3=CC=CC=C3N2)SC4=CC=CC=C4

InChI

InChI=1S/C23H17N3OS/c24-15-18(23-25-19-13-7-8-14-20(19)26-23)21(27)22(16-9-3-1-4-10-16)28-17-11-5-2-6-12-17/h1-14,18,22H,(H,25,26)/t18?,22-/m1/s1