methyl 6-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 6-[[3-[(2-bromanylphenoxy)methyl]-4-methoxy-phenyl]carbonylamino]-3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: methyl 6-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-3-chloro-benzothiophene-2-carboxylate CAS Name: 6-[[[3-[(2-bromophenoxy)methyl]-4-methoxyphenyl]-oxomethyl]amino]-3-chloro-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 6-[[3-[(2-bromophenoxy)methyl]-4-methoxybenzoyl]amino]-3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 6-[[3-[(2-bromophenoxy)methyl]-4-methoxy-benzoyl]amino]-3-chloro-benzothiophene-2-carboxylic acid methyl ester Formula: C25H19BrClNO5S MolecularWeight: 560.84406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl)COC4=CC=CC=C4Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl)COC4=CC=CC=C4Br

InChI

InChI=1S/C25H19BrClNO5S/c1-31-19-10-7-14(11-15(19)13-33-20-6-4-3-5-18(20)26)24(29)28-16-8-9-17-21(12-16)34-23(22(17)27)25(30)32-2/h3-12H,13H2,1-2H3,(H,28,29)