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

Systemtic Name: ethyl (E)-4-[(3-aminocarbonyl-4,5-dimethyl-thiophen-2-yl)carbamothioylamino]-4-oxidanylidene-but-2-enoate Openeye Name: ethyl (E)-4-[(3-carbamoyl-4,5-dimethyl-2-thienyl)carbamothioylamino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[[(3-carbamoyl-4,5-dimethyl-2-thiophenyl)amino]-sulfanylidenemethyl]amino]-4-oxo-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamothioylamino]-4-oxobut-2-enoate Traditional Name: (E)-4-[(3-carbamoyl-4,5-dimethyl-2-thienyl)thiocarbamoylamino]-4-keto-but-2-enoic acid ethyl ester Formula: C14H17N3O4S2 MolecularWeight: 355.43248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O4S2/c1-4-21-10(19)6-5-9(18)16-14(22)17-13-11(12(15)20)7(2)8(3)23-13/h5-6H,4H2,1-3H3,(H2,15,20)(H2,16,17,18,22)/b6-5+