ethyl 4-cyano-3-methyl-5-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 4-cyano-3-methyl-5-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[1-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]thiophene-2-carboxylate Traditional Name: 4-cyano-5-[[2-(2-keto-1,3-benzoxazol-3-yl)acetyl]amino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C3=CC=CC=C3OC2=O)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C3=CC=CC=C3OC2=O)C#N)C

InChI

InChI=1S/C18H15N3O5S/c1-3-25-17(23)15-10(2)11(8-19)16(27-15)20-14(22)9-21-12-6-4-5-7-13(12)26-18(21)24/h4-7H,3,9H2,1-2H3,(H,20,22)