methyl 4-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 4-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonyl-benzoate Openeye Name: methyl 4-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonyl-benzoate CAS Name: 4-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-2-methyl-5-methylsulfonylbenzoate Traditional Name: 4-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]-5-mesyl-2-methyl-benzoic acid methyl ester Formula: C19H18ClNO6S3 MolecularWeight: 487.99732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)NS(=O)(=O)C2=C(C3=C(S2)C=CC(=C3)Cl)C

InChI

InChI=1S/C19H18ClNO6S3/c1-10-7-15(17(29(4,23)24)9-13(10)18(22)27-3)21-30(25,26)19-11(2)14-8-12(20)5-6-16(14)28-19/h5-9,21H,1-4H3