5,5-dimethyl-3-[2-oxidanyl-4-phenyl-3-(quinolin-6-ylcarbonylamino)butanoyl]-N-prop-2-ynyl-1,3-thiazolidine-4-carboxamide

Systemtic Name: 5,5-dimethyl-3-[2-oxidanyl-4-phenyl-3-(quinolin-6-ylcarbonylamino)butanoyl]-N-prop-2-ynyl-1,3-thiazolidine-4-carboxamide Openeye Name: 3-[2-hydroxy-4-phenyl-3-(quinoline-6-carbonylamino)butanoyl]-5,5-dimethyl-N-prop-2-ynyl-thiazolidine-4-carboxamide CAS Name: 3-[2-hydroxy-1-oxo-3-[[oxo(6-quinolinyl)methyl]amino]-4-phenylbutyl]-5,5-dimethyl-N-prop-2-ynyl-4-thiazolidinecarboxamide IUPAC Name: 3-[2-hydroxy-4-phenyl-3-(quinoline-6-carbonylamino)butanoyl]-5,5-dimethyl-N-prop-2-ynyl-1,3-thiazolidine-4-carboxamide Traditional Name: 3-[2-hydroxy-4-phenyl-3-(quinoline-6-carbonylamino)butanoyl]-5,5-dimethyl-N-propargyl-thiazolidine-4-carboxamide Formula: C29H30N4O4S MolecularWeight: 530.6379

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CS1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=CC=C4)O)C(=O)NCC#C)C

Isomeric SMILES

CC1(C(N(CS1)C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=CC=C4)O)C(=O)NCC#C)C

InChI

InChI=1S/C29H30N4O4S/c1-4-14-31-27(36)25-29(2,3)38-18-33(25)28(37)24(34)23(16-19-9-6-5-7-10-19)32-26(35)21-12-13-22-20(17-21)11-8-15-30-22/h1,5-13,15,17,23-25,34H,14,16,18H2,2-3H3,(H,31,36)(H,32,35)