ethyl 3-[[1-(3-methylsulfanylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: ethyl 3-[[1-(3-methylsulfanylpropylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: ethyl 3-[[1-benzyl-2-(3-methylsulfanylpropylamino)-2-oxo-ethyl]carbamoyl]oxirane-2-carboxylate CAS Name: 3-[[[1-[3-(methylthio)propylamino]-1-oxo-3-phenylpropan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(3-methylsulfanylpropylamino)-1-oxo-3-phenylpropan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: 3-[[1-benzyl-2-keto-2-[3-(methylthio)propylamino]ethyl]carbamoyl]oxirane-2-carboxylic acid ethyl ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(O1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCSC

Isomeric SMILES

CCOC(=O)C1C(O1)C(=O)NC(CC2=CC=CC=C2)C(=O)NCCCSC

InChI

InChI=1S/C19H26N2O5S/c1-3-25-19(24)16-15(26-16)18(23)21-14(12-13-8-5-4-6-9-13)17(22)20-10-7-11-27-2/h4-6,8-9,14-16H,3,7,10-12H2,1-2H3,(H,20,22)(H,21,23)