methyl 2-benzamido-3-[2-(4-methoxyphenyl)-1-benzothiophen-3-yl]propanoate

Systemtic Name: methyl 2-benzamido-3-[2-(4-methoxyphenyl)-1-benzothiophen-3-yl]propanoate Openeye Name: methyl 2-benzamido-3-[2-(4-methoxyphenyl)benzothiophen-3-yl]propanoate CAS Name: 2-benzamido-3-[2-(4-methoxyphenyl)-1-benzothiophen-3-yl]propanoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-[2-(4-methoxyphenyl)-1-benzothiophen-3-yl]propanoate Traditional Name: 2-benzamido-3-[2-(4-methoxyphenyl)benzothiophen-3-yl]propionic acid methyl ester Formula: C26H23NO4S MolecularWeight: 445.53012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3S2)CC(C(=O)OC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3S2)CC(C(=O)OC)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H23NO4S/c1-30-19-14-12-17(13-15-19)24-21(20-10-6-7-11-23(20)32-24)16-22(26(29)31-2)27-25(28)18-8-4-3-5-9-18/h3-15,22H,16H2,1-2H3,(H,27,28)