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

Systemtic Name: 3-[3-(1H-indol-5-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-indole-5-carbonylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(o-tolylmethyl)thiazolidine-4-carboxamide CAS Name: 3-[2-hydroxy-3-[[1H-indol-5-yl(oxo)methyl]amino]-1-oxo-4-phenylbutyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-4-thiazolidinecarboxamide IUPAC Name: 3-[2-hydroxy-3-(1H-indole-5-carbonylamino)-4-phenylbutanoyl]-5,5-dimethyl-N-[(2-methylphenyl)methyl]-1,3-thiazolidine-4-carboxamide Traditional Name: 3-[2-hydroxy-3-(1H-indole-5-carbonylamino)-4-phenyl-butanoyl]-5,5-dimethyl-N-(2-methylbenzyl)thiazolidine-4-carboxamide Formula: C33H36N4O4S MolecularWeight: 584.72834

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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=CC5=C(C=C4)NC=C5)O)(C)C

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2C(SCN2C(=O)C(C(CC3=CC=CC=C3)NC(=O)C4=CC5=C(C=C4)NC=C5)O)(C)C

InChI

InChI=1S/C33H36N4O4S/c1-21-9-7-8-12-25(21)19-35-31(40)29-33(2,3)42-20-37(29)32(41)28(38)27(17-22-10-5-4-6-11-22)36-30(39)24-13-14-26-23(18-24)15-16-34-26/h4-16,18,27-29,34,38H,17,19-20H2,1-3H3,(H,35,40)(H,36,39)