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

Systemtic Name: ethyl 4-[4-[5-[(2-methylpropanethioylamino)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-[5-[(2-methylpropanethioylamino)methyl]-2-oxo-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[5-[[(2-methyl-1-sulfanylidenepropyl)amino]methyl]-2-oxo-3-oxazolidinyl]phenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[5-[(2-methylpropanethioylamino)methyl]-2-oxo-1,3-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[2-keto-5-[(2-methylpropanethioylamino)methyl]oxazolidin-3-yl]phenyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30N4O4S MolecularWeight: 434.5523

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H30N4O4S/c1-4-28-20(26)24-11-9-23(10-12-24)16-5-7-17(8-6-16)25-14-18(29-21(25)27)13-22-19(30)15(2)3/h5-8,15,18H,4,9-14H2,1-3H3,(H,22,30)