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

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-(4-methylpiperazin-1-yl)ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-(2-thienylmethyl)pyrrol-2-yl]-2-(4-methylpiperazin-1-yl)acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)-2-pyrrolyl]-2-(4-methyl-1-piperazinyl)acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-2-yl]-2-(4-methylpiperazin-1-yl)acetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-(2-thenyl)pyrrol-2-yl]-2-(4-methylpiperazino)acetamide Formula: C19H25N5OS MolecularWeight: 371.4997

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C)CC3=CC=CS3)C

InChI

InChI=1S/C19H25N5OS/c1-14-15(2)24(12-16-5-4-10-26-16)19(17(14)11-20)21-18(25)13-23-8-6-22(3)7-9-23/h4-5,10H,6-9,12-13H2,1-3H3,(H,21,25)