tert-butyl (4R)-4-[1-(phenylmethyl)indol-3-yl]carbonyl-2-pyridin-3-yl-1,3-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl (4R)-4-[1-(phenylmethyl)indol-3-yl]carbonyl-2-pyridin-3-yl-1,3-thiazolidine-3-carboxylate Openeye Name: tert-butyl (4R)-4-(1-benzylindole-3-carbonyl)-2-(3-pyridyl)thiazolidine-3-carboxylate CAS Name: (4R)-4-[oxo-[1-(phenylmethyl)-3-indolyl]methyl]-2-(3-pyridinyl)-3-thiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R)-4-(1-benzylindole-3-carbonyl)-2-pyridin-3-yl-1,3-thiazolidine-3-carboxylate Traditional Name: (4R)-4-(1-benzylindole-3-carbonyl)-2-(3-pyridyl)thiazolidine-3-carboxylic acid tert-butyl ester Formula: C29H29N3O3S MolecularWeight: 499.62386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CSC1C2=CN=CC=C2)C(=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](CSC1C2=CN=CC=C2)C(=O)C3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H29N3O3S/c1-29(2,3)35-28(34)32-25(19-36-27(32)21-12-9-15-30-16-21)26(33)23-18-31(17-20-10-5-4-6-11-20)24-14-8-7-13-22(23)24/h4-16,18,25,27H,17,19H2,1-3H3/t25-,27?/m0/s1