3-(3,5-dimethoxyphenyl)carbonyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenyl-1,3-thiazolidine-4-carboxamide

Systemtic Name: 3-(3,5-dimethoxyphenyl)carbonyl-N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenyl-1,3-thiazolidine-4-carboxamide Openeye Name: 3-(3,5-dimethoxybenzoyl)-N-[(3S)-2-oxoazepan-3-yl]-2-phenyl-thiazolidine-4-carboxamide CAS Name: 3-[(3,5-dimethoxyphenyl)-oxomethyl]-N-[(3S)-2-oxo-3-azepanyl]-2-phenyl-4-thiazolidinecarboxamide IUPAC Name: 3-(3,5-dimethoxybenzoyl)-N-[(3S)-2-oxoazepan-3-yl]-2-phenyl-1,3-thiazolidine-4-carboxamide Traditional Name: 3-(3,5-dimethoxybenzoyl)-N-[(3S)-2-ketoazepan-3-yl]-2-phenyl-thiazolidine-4-carboxamide Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2C(CSC2C3=CC=CC=C3)C(=O)NC4CCCCNC4=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2C(CSC2C3=CC=CC=C3)C(=O)N[C@H]4CCCCNC4=O)OC

InChI

InChI=1S/C25H29N3O5S/c1-32-18-12-17(13-19(14-18)33-2)24(31)28-21(15-34-25(28)16-8-4-3-5-9-16)23(30)27-20-10-6-7-11-26-22(20)29/h3-5,8-9,12-14,20-21,25H,6-7,10-11,15H2,1-2H3,(H,26,29)(H,27,30)/t20-,21?,25?/m0/s1