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

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]pyridine-3-carboxamide Openeye Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-2-thienyl]pyridine-3-carboxamide CAS Name: N-[3-[[2-(3,4-dimethoxyphenyl)ethylamino]-oxomethyl]-2-thiophenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]thiophen-2-yl]pyridine-3-carboxamide Traditional Name: N-[3-(homoveratrylcarbamoyl)-2-thienyl]nicotinamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=C(SC=C2)NC(=O)C3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=C(SC=C2)NC(=O)C3=CN=CC=C3)OC

InChI

InChI=1S/C21H21N3O4S/c1-27-17-6-5-14(12-18(17)28-2)7-10-23-20(26)16-8-11-29-21(16)24-19(25)15-4-3-9-22-13-15/h3-6,8-9,11-13H,7,10H2,1-2H3,(H,23,26)(H,24,25)