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

Systemtic Name: methyl 4-[4-[5-[(2-methylpropanethioylamino)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]phenyl]piperazine-1-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=S)NCC1CN(C(=O)O1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)OC

Isomeric SMILES

CC(C)C(=S)NCC1CN(C(=O)O1)C2=CC=C(C=C2)N3CCN(CC3)C(=O)OC

InChI

InChI=1S/C20H28N4O4S/c1-14(2)18(29)21-12-17-13-24(20(26)28-17)16-6-4-15(5-7-16)22-8-10-23(11-9-22)19(25)27-3/h4-7,14,17H,8-13H2,1-3H3,(H,21,29)