N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-2-thienyl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[3-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-2-thiophenyl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[3-(homoveratrylcarbamoyl)-2-thienyl]-2-methyl-pyrazole-3-carboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(=O)NC2=C(C=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C(=CC=N1)C(=O)NC2=C(C=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H22N4O4S/c1-24-15(7-10-22-24)19(26)23-20-14(8-11-29-20)18(25)21-9-6-13-4-5-16(27-2)17(12-13)28-3/h4-5,7-8,10-12H,6,9H2,1-3H3,(H,21,25)(H,23,26)