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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NC1=C(C(=C(S1)C)C)C(=O)N

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NC1=C(C(=C(S1)C)C)C(=O)N

InChI

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