methyl 2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-4-(2,5-dimethylphenyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonylamino]-4-(2,5-dimethylphenyl)thiophene-3-carboxylate Openeye Name: methyl 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-4-(2,5-dimethylphenyl)thiophene-3-carboxylate CAS Name: 2-[[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]amino]-4-(2,5-dimethylphenyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)amino]-4-(2,5-dimethylphenyl)thiophene-3-carboxylate Traditional Name: 2-[(3-chloro-6-fluoro-benzothiophene-2-carbonyl)amino]-4-(2,5-dimethylphenyl)thiophene-3-carboxylic acid methyl ester Formula: C23H17ClFNO3S2 MolecularWeight: 473.967383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CSC(=C2C(=O)OC)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CSC(=C2C(=O)OC)NC(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C23H17ClFNO3S2/c1-11-4-5-12(2)15(8-11)16-10-30-22(18(16)23(28)29-3)26-21(27)20-19(24)14-7-6-13(25)9-17(14)31-20/h4-10H,1-3H3,(H,26,27)