N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide Openeye Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-2-thienyl]-1-ethyl-pyrazole-3-carboxamide CAS Name: N-[3-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-2-thiophenyl]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]-1-ethylpyrazole-3-carboxamide Traditional Name: 1-ethyl-N-[3-(homoveratrylcarbamoyl)-2-thienyl]pyrazole-3-carboxamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C(=O)NC2=C(C=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1C=CC(=N1)C(=O)NC2=C(C=CS2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H24N4O4S/c1-4-25-11-8-16(24-25)20(27)23-21-15(9-12-30-21)19(26)22-10-7-14-5-6-17(28-2)18(13-14)29-3/h5-6,8-9,11-13H,4,7,10H2,1-3H3,(H,22,26)(H,23,27)