methyl 2-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)carbamoylamino]benzoate

Systemtic Name: methyl 2-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)carbamoylamino]benzoate Openeye Name: methyl 2-[(1-methoxycarbonyl-3-methylsulfanyl-propyl)carbamoylamino]benzoate CAS Name: 2-[[[[1-methoxy-4-(methylthio)-1-oxobutan-2-yl]amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-methoxy-4-methylsulfanyl-1-oxobutan-2-yl)carbamoylamino]benzoate Traditional Name: 2-[[1-carbomethoxy-3-(methylthio)propyl]carbamoylamino]benzoic acid methyl ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)NC(CCSC)C(=O)OC

InChI

InChI=1S/C15H20N2O5S/c1-21-13(18)10-6-4-5-7-11(10)16-15(20)17-12(8-9-23-3)14(19)22-2/h4-7,12H,8-9H2,1-3H3,(H2,16,17,20)