[1-[(1-methoxy-3-methylsulfanyl-1-oxidanylidene-propan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 4-methylpiperazine-1-carboxylate

Systemtic Name: [1-[(1-methoxy-3-methylsulfanyl-1-oxidanylidene-propan-2-yl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl] 4-methylpiperazine-1-carboxylate Openeye Name: [1-benzyl-2-[[2-methoxy-1-(methylsulfanylmethyl)-2-oxo-ethyl]amino]-2-oxo-ethyl] 4-methylpiperazine-1-carboxylate CAS Name: 4-methyl-1-piperazinecarboxylic acid [1-[[1-methoxy-3-(methylthio)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [1-[(1-methoxy-3-methylsulfanyl-1-oxopropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl] 4-methylpiperazine-1-carboxylate Traditional Name: 4-methylpiperazine-1-carboxylic acid [1-benzyl-2-keto-2-[[2-keto-2-methoxy-1-[(methylthio)methyl]ethyl]amino]ethyl] ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)OC(CC2=CC=CC=C2)C(=O)NC(CSC)C(=O)OC

Isomeric SMILES

CN1CCN(CC1)C(=O)OC(CC2=CC=CC=C2)C(=O)NC(CSC)C(=O)OC

InChI

InChI=1S/C20H29N3O5S/c1-22-9-11-23(12-10-22)20(26)28-17(13-15-7-5-4-6-8-15)18(24)21-16(14-29-3)19(25)27-2/h4-8,16-17H,9-14H2,1-3H3,(H,21,24)