[4-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-(1-benzyl-2,5-dimethylpyrrole-3-carbonyl)piperazin-1-yl]-phenylmethanone Traditional Name: [4-(1-benzyl-2,5-dimethyl-pyrrole-3-carbonyl)piperazino]-phenyl-methanone Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-19-17-23(20(2)28(19)18-21-9-5-3-6-10-21)25(30)27-15-13-26(14-16-27)24(29)22-11-7-4-8-12-22/h3-12,17H,13-16,18H2,1-2H3