4-[4-(benzimidazol-1-ylmethyl)piperidin-1-yl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[4-(benzimidazol-1-ylmethyl)piperidin-1-yl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: 4-[4-(benzimidazol-1-ylmethyl)-1-piperidyl]-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: 4-[4-(1-benzimidazolylmethyl)-1-piperidinyl]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: 4-[4-(benzimidazol-1-ylmethyl)piperidin-1-yl]-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: 4-[4-(benzimidazol-1-ylmethyl)piperidino]-3-keto-2-(4-methylthiazol-2-yl)butyronitrile Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C#N)C(=O)CN2CCC(CC2)CN3C=NC4=CC=CC=C43

Isomeric SMILES

CC1=CSC(=N1)C(C#N)C(=O)CN2CCC(CC2)CN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H23N5OS/c1-15-13-28-21(24-15)17(10-22)20(27)12-25-8-6-16(7-9-25)11-26-14-23-18-4-2-3-5-19(18)26/h2-5,13-14,16-17H,6-9,11-12H2,1H3