(2S)-4-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-4-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: (2S)-4-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: (2S)-4-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: (2S)-4-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: (2S)-3-keto-2-(4-methylthiazol-2-yl)-4-[(1-p-phenetylbenzimidazol-2-yl)thio]butyronitrile Formula: C23H20N4O2S2 MolecularWeight: 448.5605

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)C(C#N)C4=NC(=CS4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)[C@H](C#N)C4=NC(=CS4)C

InChI

InChI=1S/C23H20N4O2S2/c1-3-29-17-10-8-16(9-11-17)27-20-7-5-4-6-19(20)26-23(27)31-14-21(28)18(12-24)22-25-15(2)13-30-22/h4-11,13,18H,3,14H2,1-2H3/t18-/m0/s1