N-[[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methyl]-1-(phenylmethyl)piperidin-4-amine

Systemtic Name: N-[[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methyl]-1-(phenylmethyl)piperidin-4-amine Openeye Name: 1-benzyl-N-[[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyl]piperidin-4-amine CAS Name: N-[[2,5-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-3-pyrrolyl]methyl]-1-(phenylmethyl)-4-piperidinamine IUPAC Name: 1-benzyl-N-[[2,5-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyrrol-3-yl]methyl]piperidin-4-amine Traditional Name: (1-benzyl-4-piperidyl)-[[2,5-dimethyl-1-(3-morpholinosulfonylphenyl)pyrrol-3-yl]methyl]amine Formula: C29H38N4O3S MolecularWeight: 522.70202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)CNC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C)CNC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H38N4O3S/c1-23-19-26(21-30-27-11-13-31(14-12-27)22-25-7-4-3-5-8-25)24(2)33(23)28-9-6-10-29(20-28)37(34,35)32-15-17-36-18-16-32/h3-10,19-20,27,30H,11-18,21-22H2,1-2H3