3-[1-[3-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]propylsulfonyl]piperidin-4-yl]-5-phenyl-1H-indole-7-carboxamide

Systemtic Name: 3-[1-[3-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]propylsulfonyl]piperidin-4-yl]-5-phenyl-1H-indole-7-carboxamide Openeye Name: 3-[1-[3-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]propylsulfonyl]-4-piperidyl]-5-phenyl-1H-indole-7-carboxamide CAS Name: 3-[1-[3-[(2S,5R)-2,5-dimethyl-1-pyrrolidinyl]propylsulfonyl]-4-piperidinyl]-5-phenyl-1H-indole-7-carboxamide IUPAC Name: 3-[1-[3-[(2S,5R)-2,5-dimethylpyrrolidin-1-yl]propylsulfonyl]piperidin-4-yl]-5-phenyl-1H-indole-7-carboxamide Traditional Name: 3-[1-[3-[(2S,5R)-2,5-dimethylpyrrolidino]propylsulfonyl]-4-piperidyl]-5-phenyl-1H-indole-7-carboxamide Formula: C29H38N4O3S MolecularWeight: 522.70202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(N1CCCS(=O)(=O)N2CCC(CC2)C3=CNC4=C(C=C(C=C34)C5=CC=CC=C5)C(=O)N)C

Isomeric SMILES

C[C@@H]1CC[C@@H](N1CCCS(=O)(=O)N2CCC(CC2)C3=CNC4=C(C=C(C=C34)C5=CC=CC=C5)C(=O)N)C

InChI

InChI=1S/C29H38N4O3S/c1-20-9-10-21(2)33(20)13-6-16-37(35,36)32-14-11-23(12-15-32)27-19-31-28-25(27)17-24(18-26(28)29(30)34)22-7-4-3-5-8-22/h3-5,7-8,17-21,23,31H,6,9-16H2,1-2H3,(H2,30,34)/t20-,21+