4-methyl-N-[(1S,2S)-2-[[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]carbonyl]-1-phenyl-pentyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(1S,2S)-2-[[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]carbonyl]-1-phenyl-pentyl]benzenesulfonamide Openeye Name: N-[(1S,2S)-2-[(4R,7S)-7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazole-2-carbonyl]-1-phenyl-pentyl]-4-methyl-benzenesulfonamide CAS Name: 4-methyl-N-[(1S,2S)-2-[[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]-oxomethyl]-1-phenylpentyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(1S,2S)-2-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazole-2-carbonyl]-1-phenylpentyl]benzenesulfonamide Traditional Name: N-[(1S,2S)-2-[(4R,7S)-7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazole-2-carbonyl]-1-phenyl-pentyl]-4-methyl-benzenesulfonamide Formula: C36H43N3O3S MolecularWeight: 597.80992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)N3C(=C4C(CCC(C4=N3)C(C)C)C)C5=CC=CC=C5

Isomeric SMILES

CCC[C@@H]([C@@H](C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)C(=O)N3C(=C4[C@@H](CC[C@H](C4=N3)C(C)C)C)C5=CC=CC=C5

InChI

InChI=1S/C36H43N3O3S/c1-6-13-31(33(27-14-9-7-10-15-27)38-43(41,42)29-21-18-25(4)19-22-29)36(40)39-35(28-16-11-8-12-17-28)32-26(5)20-23-30(24(2)3)34(32)37-39/h7-12,14-19,21-22,24,26,30-31,33,38H,6,13,20,23H2,1-5H3/t26-,30+,31+,33-/m1/s1