methyl 4-[(2-aminocarbonyl-5-methoxy-1-benzothiophen-3-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(2-aminocarbonyl-5-methoxy-1-benzothiophen-3-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(2-carbamoyl-5-methoxy-benzothiophen-3-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(2-carbamoyl-5-methoxy-1-benzothiophen-3-yl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-carbamoyl-5-methoxy-1-benzothiophen-3-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(2-carbamoyl-5-methoxy-benzothiophen-3-yl)thio]methyl]benzoic acid methyl ester Formula: C19H17NO4S2 MolecularWeight: 387.47258

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=C2SCC3=CC=C(C=C3)C(=O)OC)C(=O)N

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=C2SCC3=CC=C(C=C3)C(=O)OC)C(=O)N

InChI

InChI=1S/C19H17NO4S2/c1-23-13-7-8-15-14(9-13)16(17(26-15)18(20)21)25-10-11-3-5-12(6-4-11)19(22)24-2/h3-9H,10H2,1-2H3,(H2,20,21)