methyl (2R)-3-azanylidene-2-(ethoxycarbonylcarbamothioyl)butanoate

Systemtic Name: methyl (2R)-3-azanylidene-2-(ethoxycarbonylcarbamothioyl)butanoate Openeye Name: methyl (2R)-2-(ethoxycarbonylcarbamothioyl)-3-imino-butanoate CAS Name: (2R)-2-[(ethoxycarbonylamino)-sulfanylidenemethyl]-3-iminobutanoic acid methyl ester IUPAC Name: methyl (2R)-2-(ethoxycarbonylcarbamothioyl)-3-iminobutanoate Traditional Name: (2R)-2-(carbethoxythiocarbamoyl)-3-imino-butyric acid methyl ester Formula: C9H14N2O4S MolecularWeight: 246.28346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)C(C(=N)C)C(=O)OC

Isomeric SMILES

CCOC(=O)NC(=S)[C@H](C(=N)C)C(=O)OC

InChI

InChI=1S/C9H14N2O4S/c1-4-15-9(13)11-7(16)6(5(2)10)8(12)14-3/h6,10H,4H2,1-3H3,(H,11,13,16)/t6-/m0/s1