(phenylmethyl) 3-[1-[(2-ethoxyphenyl)carbamothioyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: (phenylmethyl) 3-[1-[(2-ethoxyphenyl)carbamothioyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: benzyl 3-[1-[(2-ethoxyphenyl)carbamothioyl]-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[(2-ethoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-[(2-ethoxyphenyl)carbamothioyl]piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-(o-phenetylthiocarbamoyl)-4-piperidyl]oxazolidine-4-carboxylic acid benzyl ester Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N2CCC(CC2)N3C(COC3=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N2CCC(CC2)N3C(COC3=O)C(=O)OCC4=CC=CC=C4

InChI

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