N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide Openeye Name: N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]-2-phenyl-acetamide CAS Name: N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-2-thiazolyl]-2-phenylacetamide IUPAC Name: N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-1,3-thiazol-2-yl]-2-phenylacetamide Traditional Name: N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]-2-phenyl-acetamide Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CC3=CC=CC=C3)CC#N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CC3=CC=CC=C3)CC#N

InChI

InChI=1S/C20H17N3O2S/c1-25-18-8-7-15(12-16(18)9-10-21)17-13-26-20(22-17)23-19(24)11-14-5-3-2-4-6-14/h2-8,12-13H,9,11H2,1H3,(H,22,23,24)