(2R)-1-[[(1S,3S)-2-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-3-yl]carbonyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-[[(1S,3S)-2-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-3-yl]carbonyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-[(1S,3S)-1-isobutyl-2-(p-tolylsulfonyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carbonyl]pyrrolidine-2-carboxamide CAS Name: (2R)-1-[[(1S,3S)-2-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)-1,3,4,9-tetrahydropyrido[3,4-b]indol-3-yl]-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-[(1S,3S)-2-(4-methylphenyl)sulfonyl-1-(2-methylpropyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carbonyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-[(1S,3S)-1-isobutyl-2-tosyl-1,3,4,9-tetrahydro-$b-carboline-3-carbonyl]pyrrolidine-2-carboxamide Formula: C28H34N4O4S MolecularWeight: 522.65896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC3=C(C2CC(C)C)NC4=CC=CC=C34)C(=O)N5CCCC5C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](CC3=C([C@@H]2CC(C)C)NC4=CC=CC=C34)C(=O)N5CCC[C@@H]5C(=O)N

InChI

InChI=1S/C28H34N4O4S/c1-17(2)15-24-26-21(20-7-4-5-8-22(20)30-26)16-25(28(34)31-14-6-9-23(31)27(29)33)32(24)37(35,36)19-12-10-18(3)11-13-19/h4-5,7-8,10-13,17,23-25,30H,6,9,14-16H2,1-3H3,(H2,29,33)/t23-,24+,25+/m1/s1