ethyl 3-methyl-5-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-[1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetyl]amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[2-[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetyl]amino]thiophene-2-carboxylate Traditional Name: 5-[[2-[[2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC(C)C(=O)NC2=NOC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC(C)C(=O)NC2=NOC(=C2)C)C

InChI

InChI=1S/C17H21N3O5S2/c1-5-24-17(23)15-9(2)6-14(27-15)19-13(21)8-26-11(4)16(22)18-12-7-10(3)25-20-12/h6-7,11H,5,8H2,1-4H3,(H,19,21)(H,18,20,22)