4-(2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide

Systemtic Name: 4-(2-oxidanylidene-4-phenyl-1,3-oxazolidin-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide Openeye Name: 4-(2-oxo-4-phenyl-oxazolidin-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide CAS Name: 4-(2-oxo-4-phenyl-3-oxazolidinyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1-piperidinecarbothioamide IUPAC Name: 4-(2-oxo-4-phenyl-1,3-oxazolidin-3-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide Traditional Name: 4-(2-keto-4-phenyl-oxazolidin-3-yl)-N-(3,4,5-trimethoxybenzyl)piperidine-1-carbothioamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=S)N2CCC(CC2)N3C(COC3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=S)N2CCC(CC2)N3C(COC3=O)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O5S/c1-30-21-13-17(14-22(31-2)23(21)32-3)15-26-24(34)27-11-9-19(10-12-27)28-20(16-33-25(28)29)18-7-5-4-6-8-18/h4-8,13-14,19-20H,9-12,15-16H2,1-3H3,(H,26,34)