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

Systemtic Name: 1-[4-[2-methyl-5-[[3-(4-methylpiperazin-1-yl)carbonyl-4-naphthalen-1-yl-pyrrol-1-yl]methyl]imidazol-1-yl]piperidin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-[2-methyl-5-[[3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-1-yl]methyl]imidazol-1-yl]-1-piperidyl]-3-phenyl-propan-1-one CAS Name: 1-[4-[2-methyl-5-[[3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-(1-naphthalenyl)-1-pyrrolyl]methyl]-1-imidazolyl]-1-piperidinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-[2-methyl-5-[[3-(4-methylpiperazine-1-carbonyl)-4-naphthalen-1-ylpyrrol-1-yl]methyl]imidazol-1-yl]piperidin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-[2-methyl-5-[[3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-1-yl]methyl]imidazol-1-yl]piperidino]-3-phenyl-propan-1-one Formula: C39H44N6O2 MolecularWeight: 628.80566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C2CCN(CC2)C(=O)CCC3=CC=CC=C3)CN4C=C(C(=C4)C(=O)N5CCN(CC5)C)C6=CC=CC7=CC=CC=C76

Isomeric SMILES

CC1=NC=C(N1C2CCN(CC2)C(=O)CCC3=CC=CC=C3)CN4C=C(C(=C4)C(=O)N5CCN(CC5)C)C6=CC=CC7=CC=CC=C76

InChI

InChI=1S/C39H44N6O2/c1-29-40-25-33(45(29)32-17-19-43(20-18-32)38(46)16-15-30-9-4-3-5-10-30)26-42-27-36(35-14-8-12-31-11-6-7-13-34(31)35)37(28-42)39(47)44-23-21-41(2)22-24-44/h3-14,25,27-28,32H,15-24,26H2,1-2H3