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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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