methyl 2-[2-(3-phenoxyphenyl)ethanoylamino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate

Systemtic Name: methyl 2-[2-(3-phenoxyphenyl)ethanoylamino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate Openeye Name: methyl 2-[[2-(3-phenoxyphenyl)acetyl]amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate CAS Name: 2-[[1-oxo-2-(3-phenoxyphenyl)ethyl]amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-phenoxyphenyl)acetyl]amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylate Traditional Name: 2-[[2-(3-phenoxyphenyl)acetyl]amino]-5,6-dihydro-4H-thieno[2,3-b]thiopyran-3-carboxylic acid methyl ester Formula: C23H21NO4S2 MolecularWeight: 439.54714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCS2)NC(=O)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCS2)NC(=O)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H21NO4S2/c1-27-22(26)20-18-11-6-12-29-23(18)30-21(20)24-19(25)14-15-7-5-10-17(13-15)28-16-8-3-2-4-9-16/h2-5,7-10,13H,6,11-12,14H2,1H3,(H,24,25)