N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]ethanamide Openeye Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]acetamide CAS Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)-2-[4-(2-nitrophenyl)-1-piperazinyl]acetamide IUPAC Name: N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)-2-[4-(2-nitrophenyl)piperazin-1-yl]acetamide Traditional Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(2-nitrophenyl)piperazino]acetamide Formula: C25H32N6O3 MolecularWeight: 464.55998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-])C4CCCCC4)C

InChI

InChI=1S/C25H32N6O3/c1-18-19(2)30(20-8-4-3-5-9-20)25(21(18)16-26)27-24(32)17-28-12-14-29(15-13-28)22-10-6-7-11-23(22)31(33)34/h6-7,10-11,20H,3-5,8-9,12-15,17H2,1-2H3,(H,27,32)