3-[3-(1H-indazol-4-ylcarbonylamino)-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide

Systemtic Name: 3-[3-(1H-indazol-4-ylcarbonylamino)-2-oxidanyl-4-phenyl-butanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide Openeye Name: 3-[2-hydroxy-3-(1H-indazole-4-carbonylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(o-tolylmethyl)thiazolidine-4-carboxamide CAS Name: 3-[2-hydroxy-3-[[1H-indazol-4-yl(oxo)methyl]amino]-1-oxo-4-phenylbutyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-4-thiazolidinecarboxamide IUPAC Name: 3-[2-hydroxy-3-(1H-indazole-4-carbonylamino)-4-phenylbutanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide Traditional Name: 3-[2-hydroxy-3-(1H-indazole-4-carbonylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(2-methylbenzyl)thiazolidine-4-carboxamide Formula: C32H35N5O4S MolecularWeight: 585.7164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2C(SCN2C(=O)C(C(CC3=CC=CC=C3)NC(=O)C4=C5C=NNC5=CC=C4)O)(C)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2C(SCN2C(=O)C(C(CC3=CC=CC=C3)NC(=O)C4=C5C=NNC5=CC=C4)O)(C)C

InChI

InChI=1S/C32H35N5O4S/c1-20-10-7-8-13-22(20)17-33-30(40)28-32(2,3)42-19-37(28)31(41)27(38)26(16-21-11-5-4-6-12-21)35-29(39)23-14-9-15-25-24(23)18-34-36-25/h4-15,18,26-28,38H,16-17,19H2,1-3H3,(H,33,40)(H,34,36)(H,35,39)