methyl 4-[(3-chloranyl-6-cyano-1-benzothiophen-2-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(3-chloranyl-6-cyano-1-benzothiophen-2-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(3-chloro-6-cyano-benzothiophene-2-carbonyl)amino]benzoate CAS Name: 4-[[(3-chloro-6-cyano-1-benzothiophen-2-yl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-chloro-6-cyano-1-benzothiophene-2-carbonyl)amino]benzoate Traditional Name: 4-[(3-chloro-6-cyano-benzothiophene-2-carbonyl)amino]benzoic acid methyl ester Formula: C18H11ClN2O3S MolecularWeight: 370.80954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)C#N)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H11ClN2O3S/c1-24-18(23)11-3-5-12(6-4-11)21-17(22)16-15(19)13-7-2-10(9-20)8-14(13)25-16/h2-8H,1H3,(H,21,22)