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

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoylamino]thiophene-3-carboxylate Traditional Name: 2-[4-(2-keto-1,3-benzoxazol-3-yl)butanoylamino]-4-methyl-5-(methylcarbamoyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)CCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C21H23N3O6S/c1-4-29-20(27)16-12(2)17(18(26)22-3)31-19(16)23-15(25)10-7-11-24-13-8-5-6-9-14(13)30-21(24)28/h5-6,8-9H,4,7,10-11H2,1-3H3,(H,22,26)(H,23,25)