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

Systemtic Name: 5,5-dimethyl-N-[(2-methylphenyl)methyl]-3-[3-(2-methylpropanoylamino)-2-oxidanyl-4-phenyl-butanoyl]-1,3-thiazolidine-4-carboxamide Openeye Name: 3-[2-hydroxy-3-(2-methylpropanoylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(o-tolylmethyl)thiazolidine-4-carboxamide CAS Name: 3-[2-hydroxy-3-[(2-methyl-1-oxopropyl)amino]-1-oxo-4-phenylbutyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-4-thiazolidinecarboxamide IUPAC Name: 3-[2-hydroxy-3-(2-methylpropanoylamino)-4-phenylbutanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide Traditional Name: 3-[2-hydroxy-3-(isobutyrylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(2-methylbenzyl)thiazolidine-4-carboxamide Formula: C28H37N3O4S MolecularWeight: 511.67608

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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)C(C)C)O)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H37N3O4S/c1-18(2)25(33)30-22(15-20-12-7-6-8-13-20)23(32)27(35)31-17-36-28(4,5)24(31)26(34)29-16-21-14-10-9-11-19(21)3/h6-14,18,22-24,32H,15-17H2,1-5H3,(H,29,34)(H,30,33)