3-(2-chlorophenyl)carbonyl-2-(furan-3-yl)-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3-thiazolidine-4-carboxamide

Systemtic Name: 3-(2-chlorophenyl)carbonyl-2-(furan-3-yl)-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3-thiazolidine-4-carboxamide Openeye Name: 3-(2-chlorobenzoyl)-2-(3-furyl)-N-[(3S)-2-oxoazepan-3-yl]thiazolidine-4-carboxamide CAS Name: 3-[(2-chlorophenyl)-oxomethyl]-2-(3-furanyl)-N-[(3S)-2-oxo-3-azepanyl]-4-thiazolidinecarboxamide IUPAC Name: 3-(2-chlorobenzoyl)-2-(furan-3-yl)-N-[(3S)-2-oxoazepan-3-yl]-1,3-thiazolidine-4-carboxamide Traditional Name: 3-(2-chlorobenzoyl)-2-(3-furyl)-N-[(3S)-2-ketoazepan-3-yl]thiazolidine-4-carboxamide Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2CSC(N2C(=O)C3=CC=CC=C3Cl)C4=COC=C4

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NC(=O)C2CSC(N2C(=O)C3=CC=CC=C3Cl)C4=COC=C4

InChI

InChI=1S/C21H22ClN3O4S/c22-15-6-2-1-5-14(15)20(28)25-17(12-30-21(25)13-8-10-29-11-13)19(27)24-16-7-3-4-9-23-18(16)26/h1-2,5-6,8,10-11,16-17,21H,3-4,7,9,12H2,(H,23,26)(H,24,27)/t16-,17?,21?/m0/s1