methyl 3-chloranyl-6-[(4-chloranyl-1-ethyl-pyrazol-3-yl)carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-[(4-chloranyl-1-ethyl-pyrazol-3-yl)carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-[(4-chloro-1-ethyl-pyrazole-3-carbonyl)amino]benzothiophene-2-carboxylate CAS Name: 3-chloro-6-[[(4-chloro-1-ethyl-3-pyrazolyl)-oxomethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-[(4-chloro-1-ethylpyrazole-3-carbonyl)amino]-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-[(4-chloro-1-ethyl-pyrazole-3-carbonyl)amino]benzothiophene-2-carboxylic acid methyl ester Formula: C16H13Cl2N3O3S MolecularWeight: 398.26372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl)Cl

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl)Cl

InChI

InChI=1S/C16H13Cl2N3O3S/c1-3-21-7-10(17)13(20-21)15(22)19-8-4-5-9-11(6-8)25-14(12(9)18)16(23)24-2/h4-7H,3H2,1-2H3,(H,19,22)