methyl 3-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-oxidanylidene-2-[(phenylmethyl)carbamoylamino]ethyl]sulfanylpropanoate Openeye Name: methyl 3-[2-(benzylcarbamoylamino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 3-[[2-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(benzylcarbamoylamino)-2-oxoethyl]sulfanylpropanoate Traditional Name: 3-[[2-(benzylcarbamoylamino)-2-keto-ethyl]thio]propionic acid methyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NC(=O)NCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCSCC(=O)NC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C14H18N2O4S/c1-20-13(18)7-8-21-10-12(17)16-14(19)15-9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,15,16,17,19)