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

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-[(3-nitrophenyl)amino]ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-(2-thienylmethyl)pyrrol-2-yl]-2-(3-nitroanilino)acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)-2-pyrrolyl]-2-(3-nitroanilino)acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-(3-nitroanilino)acetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-(2-thenyl)pyrrol-2-yl]-2-(3-nitroanilino)acetamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CNC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CS3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CNC2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CS3)C

InChI

InChI=1S/C20H19N5O3S/c1-13-14(2)24(12-17-7-4-8-29-17)20(18(13)10-21)23-19(26)11-22-15-5-3-6-16(9-15)25(27)28/h3-9,22H,11-12H2,1-2H3,(H,23,26)