[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-methyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 3-methylbenzothiophene-2-carboxylate CAS Name: 3-methyl-1-benzothiophene-2-carboxylic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 3-methylbenzothiophene-2-carboxylic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H20N2O4S MolecularWeight: 348.4167

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=C(C2=CC=CC=C2S1)C

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=C(C2=CC=CC=C2S1)C

InChI

InChI=1S/C17H20N2O4S/c1-3-4-9-18-17(22)19-14(20)10-23-16(21)15-11(2)12-7-5-6-8-13(12)24-15/h5-8H,3-4,9-10H2,1-2H3,(H2,18,19,20,22)