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

Systemtic Name: ethyl 5-ethyl-2-[2-(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[[2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[[2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[[2-(3-keto-2-methyl-1,4-benzoxazin-4-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CN2C3=CC=CC=C3OC(C2=O)C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CN2C3=CC=CC=C3OC(C2=O)C)C(=O)OCC

InChI

InChI=1S/C20H22N2O5S/c1-4-13-10-14(20(25)26-5-2)18(28-13)21-17(23)11-22-15-8-6-7-9-16(15)27-12(3)19(22)24/h6-10,12H,4-5,11H2,1-3H3,(H,21,23)