[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H19ClN2O4S MolecularWeight: 382.86176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C17H19ClN2O4S/c1-10(2)7-8-19-17(23)20-13(21)9-24-16(22)15-14(18)11-5-3-4-6-12(11)25-15/h3-6,10H,7-9H2,1-2H3,(H2,19,20,21,23)