1-[4-[[5-[1-methyl-3-(4-methylpiperazin-1-yl)carbonyl-4-naphthalen-1-yl-pyrrol-2-yl]imidazol-1-yl]methyl]piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazin-1-yl)carbonyl-4-naphthalen-1-yl-pyrrol-2-yl]imidazol-1-yl]methyl]piperidin-1-yl]ethanone Openeye Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-2-yl]imidazol-1-yl]methyl]-1-piperidyl]ethanone CAS Name: 1-[4-[[5-[1-methyl-3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-(1-naphthalenyl)-2-pyrrolyl]-1-imidazolyl]methyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazine-1-carbonyl)-4-naphthalen-1-ylpyrrol-2-yl]imidazol-1-yl]methyl]piperidin-1-yl]ethanone Traditional Name: 1-[4-[[5-[1-methyl-3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-2-yl]imidazol-1-yl]methyl]piperidino]ethanone Formula: C32H38N6O2 MolecularWeight: 538.68312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)CN2C=NC=C2C3=C(C(=CN3C)C4=CC=CC5=CC=CC=C54)C(=O)N6CCN(CC6)C

Isomeric SMILES

CC(=O)N1CCC(CC1)CN2C=NC=C2C3=C(C(=CN3C)C4=CC=CC5=CC=CC=C54)C(=O)N6CCN(CC6)C

InChI

InChI=1S/C32H38N6O2/c1-23(39)36-13-11-24(12-14-36)20-38-22-33-19-29(38)31-30(32(40)37-17-15-34(2)16-18-37)28(21-35(31)3)27-10-6-8-25-7-4-5-9-26(25)27/h4-10,19,21-22,24H,11-18,20H2,1-3H3