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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=C(C(=C(S3)C)C)C(=O)OC

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=C(C(=C(S3)C)C)C(=O)OC

InChI

InChI=1S/C20H22N2O5S/c1-11-13(3)28-18(17(11)20(25)26-4)21-16(23)9-10-22-14-7-5-6-8-15(14)27-12(2)19(22)24/h5-8,12H,9-10H2,1-4H3,(H,21,23)