ethyl 4-[4-[5-[(ethanethioylamino)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-[5-[(ethanethioylamino)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-[5-[(ethanethioylamino)methyl]-2-oxo-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[2-oxo-5-[(1-sulfanylideneethylamino)methyl]-3-oxazolidinyl]phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[5-[(ethanethioylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[2-keto-5-[(thioacetylamino)methyl]oxazolidin-3-yl]phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC=C(C=C2)N3CC(OC3=O)CNC(=S)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC=C(C=C2)N3CC(OC3=O)CNC(=S)C

InChI

InChI=1S/C19H26N4O4S/c1-3-26-18(24)22-10-8-21(9-11-22)15-4-6-16(7-5-15)23-13-17(27-19(23)25)12-20-14(2)28/h4-7,17H,3,8-13H2,1-2H3,(H,20,28)