methyl 3-(aminocarbonylamino)-2-cyano-3-methylsulfanyl-prop-2-enoate

Systemtic Name: methyl 3-(aminocarbonylamino)-2-cyano-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl 2-cyano-3-methylsulfanyl-3-ureido-prop-2-enoate CAS Name: 3-(carbamoylamino)-2-cyano-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl 3-(carbamoylamino)-2-cyano-3-methylsulfanylprop-2-enoate Traditional Name: 2-cyano-3-(methylthio)-3-ureido-acrylic acid methyl ester Formula: C7H9N3O3S MolecularWeight: 215.22966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(NC(=O)N)SC)C#N

Isomeric SMILES

COC(=O)C(=C(NC(=O)N)SC)C#N

InChI

InChI=1S/C7H9N3O3S/c1-13-6(11)4(3-8)5(14-2)10-7(9)12/h1-2H3,(H3,9,10,12)