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

Systemtic Name: 4-cyano-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-cyano-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]benzamide CAS Name: 4-cyano-N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-2-thiazolyl]benzamide IUPAC Name: 4-cyano-N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-cyano-N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]benzamide Formula: C20H14N4O2S MolecularWeight: 374.41576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4O2S/c1-26-18-7-6-15(10-16(18)8-9-21)17-12-27-20(23-17)24-19(25)14-4-2-13(11-22)3-5-14/h2-7,10,12H,8H2,1H3,(H,23,24,25)