(2S,4S)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-4-phenyl-4-phenylsulfanyl-butanenitrile

Systemtic Name: (2S,4S)-2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-4-phenyl-4-phenylsulfanyl-butanenitrile Openeye Name: (2S,4S)-2-(1-methylbenzimidazol-2-yl)-3-oxo-4-phenyl-4-phenylsulfanyl-butanenitrile CAS Name: (2S,4S)-2-(1-methyl-2-benzimidazolyl)-3-oxo-4-phenyl-4-(phenylthio)butanenitrile IUPAC Name: (2S,4S)-2-(1-methylbenzimidazol-2-yl)-3-oxo-4-phenyl-4-phenylsulfanylbutanenitrile Traditional Name: (2S,4S)-3-keto-2-(1-methylbenzimidazol-2-yl)-4-phenyl-4-(phenylthio)butyronitrile Formula: C24H19N3OS MolecularWeight: 397.49216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C#N)C(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@H](C#N)C(=O)[C@H](C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H19N3OS/c1-27-21-15-9-8-14-20(21)26-24(27)19(16-25)22(28)23(17-10-4-2-5-11-17)29-18-12-6-3-7-13-18/h2-15,19,23H,1H3/t19-,23+/m1/s1