N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-[(2-methoxyphenyl)amino]ethanamide

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-[(2-methoxyphenyl)amino]ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-(2-thienylmethyl)pyrrol-2-yl]-2-(2-methoxyanilino)acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)-2-pyrrolyl]-2-(2-methoxyanilino)acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-(2-methoxyanilino)acetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-(2-thenyl)pyrrol-2-yl]-2-(o-anisidino)acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CNC2=CC=CC=C2OC)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CNC2=CC=CC=C2OC)CC3=CC=CS3)C

InChI

InChI=1S/C21H22N4O2S/c1-14-15(2)25(13-16-7-6-10-28-16)21(17(14)11-22)24-20(26)12-23-18-8-4-5-9-19(18)27-3/h4-10,23H,12-13H2,1-3H3,(H,24,26)