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

Systemtic Name: [4-[2-methyl-5-[[3-(4-methylpiperazin-1-yl)carbonyl-4-naphthalen-1-yl-pyrrol-1-yl]methyl]imidazol-1-yl]piperidin-1-yl]-naphthalen-2-yl-methanone Openeye Name: [4-[2-methyl-5-[[3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-1-yl]methyl]imidazol-1-yl]-1-piperidyl]-(2-naphthyl)methanone CAS Name: [4-[2-methyl-5-[[3-[(4-methyl-1-piperazinyl)-oxomethyl]-4-(1-naphthalenyl)-1-pyrrolyl]methyl]-1-imidazolyl]-1-piperidinyl]-(2-naphthalenyl)methanone IUPAC Name: [4-[2-methyl-5-[[3-(4-methylpiperazine-1-carbonyl)-4-naphthalen-1-ylpyrrol-1-yl]methyl]imidazol-1-yl]piperidin-1-yl]-naphthalen-2-ylmethanone Traditional Name: [4-[2-methyl-5-[[3-(4-methylpiperazine-1-carbonyl)-4-(1-naphthyl)pyrrol-1-yl]methyl]imidazol-1-yl]piperidino]-(2-naphthyl)methanone Formula: C41H42N6O2 MolecularWeight: 650.81118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)CN5C=C(C(=C5)C(=O)N6CCN(CC6)C)C7=CC=CC8=CC=CC=C87

Isomeric SMILES

CC1=NC=C(N1C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)CN5C=C(C(=C5)C(=O)N6CCN(CC6)C)C7=CC=CC8=CC=CC=C87

InChI

InChI=1S/C41H42N6O2/c1-29-42-25-35(47(29)34-16-18-45(19-17-34)40(48)33-15-14-30-8-3-4-10-32(30)24-33)26-44-27-38(37-13-7-11-31-9-5-6-12-36(31)37)39(28-44)41(49)46-22-20-43(2)21-23-46/h3-15,24-25,27-28,34H,16-23,26H2,1-2H3