2-(3,4-dimethoxyphenyl)-3-(2-methylpropanoyl)-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3-thiazolidine-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-(2-methylpropanoyl)-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3-thiazolidine-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(2-methylpropanoyl)-N-[(3S)-2-oxoazepan-3-yl]thiazolidine-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-3-(2-methyl-1-oxopropyl)-N-[(3S)-2-oxo-3-azepanyl]-4-thiazolidinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(2-methylpropanoyl)-N-[(3S)-2-oxoazepan-3-yl]-1,3-thiazolidine-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-3-isobutyryl-N-[(3S)-2-ketoazepan-3-yl]thiazolidine-4-carboxamide Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(CSC1C2=CC(=C(C=C2)OC)OC)C(=O)NC3CCCCNC3=O

Isomeric SMILES

CC(C)C(=O)N1C(CSC1C2=CC(=C(C=C2)OC)OC)C(=O)N[C@H]3CCCCNC3=O

InChI

InChI=1S/C22H31N3O5S/c1-13(2)21(28)25-16(20(27)24-15-7-5-6-10-23-19(15)26)12-31-22(25)14-8-9-17(29-3)18(11-14)30-4/h8-9,11,13,15-16,22H,5-7,10,12H2,1-4H3,(H,23,26)(H,24,27)/t15-,16?,22?/m0/s1