(2S,3S)-2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]-3-phenyl-pentan-1-one

Systemtic Name: (2S,3S)-2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]-3-phenyl-pentan-1-one Openeye Name: (2S,3S)-1-[(4R,7S)-7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazol-2-yl]-2-methyl-3-phenyl-pentan-1-one CAS Name: (2S,3S)-2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]-3-phenyl-1-pentanone IUPAC Name: (2S,3S)-2-methyl-1-[(4R,7S)-4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl]-3-phenylpentan-1-one Traditional Name: (2S,3S)-1-[(4R,7S)-7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazol-2-yl]-2-methyl-3-phenyl-pentan-1-one Formula: C29H36N2O MolecularWeight: 428.60894

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(C)C(=O)N2C(=C3C(CCC(C3=N2)C(C)C)C)C4=CC=CC=C4

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)[C@H](C)C(=O)N2C(=C3[C@@H](CC[C@H](C3=N2)C(C)C)C)C4=CC=CC=C4

InChI

InChI=1S/C29H36N2O/c1-6-24(22-13-9-7-10-14-22)21(5)29(32)31-28(23-15-11-8-12-16-23)26-20(4)17-18-25(19(2)3)27(26)30-31/h7-16,19-21,24-25H,6,17-18H2,1-5H3/t20-,21+,24+,25+/m1/s1