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

Systemtic Name: 5,5-dimethyl-N-[(2-methylphenyl)methyl]-3-[2-oxidanyl-4-phenyl-3-(piperidin-4-ylcarbonylamino)butanoyl]-1,3-thiazolidine-4-carboxamide Openeye Name: 3-[2-hydroxy-4-phenyl-3-(piperidine-4-carbonylamino)butanoyl]-5,5-dimethyl-N-(o-tolylmethyl)thiazolidine-4-carboxamide CAS Name: 3-[2-hydroxy-1-oxo-3-[[oxo(4-piperidinyl)methyl]amino]-4-phenylbutyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-4-thiazolidinecarboxamide IUPAC Name: 3-[2-hydroxy-4-phenyl-3-(piperidine-4-carbonylamino)butanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide Traditional Name: 3-[2-hydroxy-3-(isonipecotoylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(2-methylbenzyl)thiazolidine-4-carboxamide Formula: C30H40N4O4S MolecularWeight: 552.728

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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)C4CCNCC4)O)(C)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2C(SCN2C(=O)C(C(CC3=CC=CC=C3)NC(=O)C4CCNCC4)O)(C)C

InChI

InChI=1S/C30H40N4O4S/c1-20-9-7-8-12-23(20)18-32-28(37)26-30(2,3)39-19-34(26)29(38)25(35)24(17-21-10-5-4-6-11-21)33-27(36)22-13-15-31-16-14-22/h4-12,22,24-26,31,35H,13-19H2,1-3H3,(H,32,37)(H,33,36)