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

Systemtic Name: N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide Openeye Name: N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]thiophene-2-carboxamide CAS Name: N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-2-thiazolyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[3-(cyanomethyl)-4-methoxyphenyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide Traditional Name: N-[4-[3-(cyanomethyl)-4-methoxy-phenyl]thiazol-2-yl]thiophene-2-carboxamide Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CS3)CC#N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CS3)CC#N

InChI

InChI=1S/C17H13N3O2S2/c1-22-14-5-4-11(9-12(14)6-7-18)13-10-24-17(19-13)20-16(21)15-3-2-8-23-15/h2-5,8-10H,6H2,1H3,(H,19,20,21)