propan-2-yl 2-[2-(2-chloranyl-5-methylsulfanyl-phenyl)carbonyloxyethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: propan-2-yl 2-[2-(2-chloranyl-5-methylsulfanyl-phenyl)carbonyloxyethanoylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: isopropyl 2-[[2-(2-chloro-5-methylsulfanyl-benzoyl)oxyacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[[2-chloro-5-(methylthio)phenyl]-oxomethoxy]-1-oxoethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(2-chloro-5-methylsulfanylbenzoyl)oxyacetyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[2-chloro-5-(methylthio)benzoyl]oxyacetyl]amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid isopropyl ester Formula: C23H26ClNO5S2 MolecularWeight: 496.03924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)COC(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)COC(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C23H26ClNO5S2/c1-12(2)30-23(28)20-15-7-5-13(3)9-18(15)32-21(20)25-19(26)11-29-22(27)16-10-14(31-4)6-8-17(16)24/h6,8,10,12-13H,5,7,9,11H2,1-4H3,(H,25,26)