2-methyl-1-(4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl)-3-phenylsulfanyl-butan-1-one

Systemtic Name: 2-methyl-1-(4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl)-3-phenylsulfanyl-butan-1-one Openeye Name: 1-(7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazol-2-yl)-2-methyl-3-phenylsulfanyl-butan-1-one CAS Name: 2-methyl-1-(4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl)-3-(phenylthio)-1-butanone IUPAC Name: 2-methyl-1-(4-methyl-3-phenyl-7-propan-2-yl-4,5,6,7-tetrahydroindazol-2-yl)-3-phenylsulfanylbutan-1-one Traditional Name: 1-(7-isopropyl-4-methyl-3-phenyl-4,5,6,7-tetrahydroindazol-2-yl)-2-methyl-3-(phenylthio)butan-1-one Formula: C28H34N2OS MolecularWeight: 446.64736

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2=NN(C(=C12)C3=CC=CC=C3)C(=O)C(C)C(C)SC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC1CCC(C2=NN(C(=C12)C3=CC=CC=C3)C(=O)C(C)C(C)SC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C28H34N2OS/c1-18(2)24-17-16-19(3)25-26(24)29-30(27(25)22-12-8-6-9-13-22)28(31)20(4)21(5)32-23-14-10-7-11-15-23/h6-15,18-21,24H,16-17H2,1-5H3