2-[4-(4-methylphenyl)-3H-1,3-thiazol-2-ylidene]-3-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]butanenitrile

Systemtic Name: 2-[4-(4-methylphenyl)-3H-1,3-thiazol-2-ylidene]-3-oxidanylidene-4-[4-(phenylmethyl)piperidin-1-yl]butanenitrile Openeye Name: 4-(4-benzyl-1-piperidyl)-3-oxo-2-[4-(p-tolyl)-3H-thiazol-2-ylidene]butanenitrile CAS Name: 2-[4-(4-methylphenyl)-3H-thiazol-2-ylidene]-3-oxo-4-[4-(phenylmethyl)-1-piperidinyl]butanenitrile IUPAC Name: 4-(4-benzylpiperidin-1-yl)-2-[4-(4-methylphenyl)-3H-1,3-thiazol-2-ylidene]-3-oxobutanenitrile Traditional Name: 4-(4-benzylpiperidino)-3-keto-2-[4-(p-tolyl)-4-thiazolin-2-ylidene]butyronitrile Formula: C26H27N3OS MolecularWeight: 429.57708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C(C#N)C(=O)CN3CCC(CC3)CC4=CC=CC=C4)N2

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C(C#N)C(=O)CN3CCC(CC3)CC4=CC=CC=C4)N2

InChI

InChI=1S/C26H27N3OS/c1-19-7-9-22(10-8-19)24-18-31-26(28-24)23(16-27)25(30)17-29-13-11-21(12-14-29)15-20-5-3-2-4-6-20/h2-10,18,21,28H,11-15,17H2,1H3