methyl 4-[(3-aminocarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[(3-aminocarbonyl-4-ethyl-5-methyl-thiophen-2-yl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[(3-carbamoyl-4-ethyl-5-methyl-2-thienyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[(3-carbamoyl-4-ethyl-5-methyl-2-thiophenyl)amino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[(3-carbamoyl-4-ethyl-5-methylthiophen-2-yl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(3-carbamoyl-4-ethyl-5-methyl-2-thienyl)thiocarbamoylamino]-4-keto-butyric acid methyl ester Formula: C14H19N3O4S2 MolecularWeight: 357.44836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CCC(=O)OC)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)N)NC(=S)NC(=O)CCC(=O)OC)C

InChI

InChI=1S/C14H19N3O4S2/c1-4-8-7(2)23-13(11(8)12(15)20)17-14(22)16-9(18)5-6-10(19)21-3/h4-6H2,1-3H3,(H2,15,20)(H2,16,17,18,22)