[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3,6-bis(chloranyl)-1-benzothiophene-2-carboxylate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3,6-dichlorobenzothiophene-2-carboxylate CAS Name: 3,6-dichloro-1-benzothiophene-2-carboxylic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3,6-dichloro-1-benzothiophene-2-carboxylate Traditional Name: 3,6-dichlorobenzothiophene-2-carboxylic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H12Cl2N2O4S MolecularWeight: 387.23778

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)C1=C(C2=C(S1)C=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H12Cl2N2O4S/c1-2-5-18-15(22)19-11(20)7-23-14(21)13-12(17)9-4-3-8(16)6-10(9)24-13/h2-4,6H,1,5,7H2,(H2,18,19,20,22)