1-(2-cyanoethyl)-N-(4-methoxyphenyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-N-(4-methoxyphenyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-N-(4-methoxyphenyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-N-(4-methoxyphenyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-N-(4-methoxyphenyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-N-(4-methoxyphenyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CCC#N

InChI

InChI=1S/C18H16N4O2S/c1-24-14-7-5-13(6-8-14)20-18(23)15-12-22(10-3-9-19)21-17(15)16-4-2-11-25-16/h2,4-8,11-12H,3,10H2,1H3,(H,20,23)