[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-acetamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C

Isomeric SMILES

CC(C(=O)NCC=C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C

InChI

InChI=1S/C17H22N2O4S/c1-4-9-18-15(21)10(2)23-17(22)14-12-7-5-6-8-13(12)24-16(14)19-11(3)20/h4,10H,1,5-9H2,2-3H3,(H,18,21)(H,19,20)