N-[5-[1,2-bis(oxidanyl)ethyl]pyrazin-2-yl]-2-methyl-4-(4-methylsulfonylphenoxy)-1-benzothiophene-6-carboxamide

Systemtic Name: N-[5-[1,2-bis(oxidanyl)ethyl]pyrazin-2-yl]-2-methyl-4-(4-methylsulfonylphenoxy)-1-benzothiophene-6-carboxamide Openeye Name: N-[5-(1,2-dihydroxyethyl)pyrazin-2-yl]-2-methyl-4-(4-methylsulfonylphenoxy)benzothiophene-6-carboxamide CAS Name: N-[5-(1,2-dihydroxyethyl)-2-pyrazinyl]-2-methyl-4-(4-methylsulfonylphenoxy)-1-benzothiophene-6-carboxamide IUPAC Name: N-[5-(1,2-dihydroxyethyl)pyrazin-2-yl]-2-methyl-4-(4-methylsulfonylphenoxy)-1-benzothiophene-6-carboxamide Traditional Name: N-[5-(1,2-dihydroxyethyl)pyrazin-2-yl]-4-(4-mesylphenoxy)-2-methyl-benzothiophene-6-carboxamide Formula: C23H21N3O6S2 MolecularWeight: 499.55934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C(C=C2S1)C(=O)NC3=NC=C(N=C3)C(CO)O)OC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C(C=C2S1)C(=O)NC3=NC=C(N=C3)C(CO)O)OC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H21N3O6S2/c1-13-7-17-20(32-15-3-5-16(6-4-15)34(2,30)31)8-14(9-21(17)33-13)23(29)26-22-11-24-18(10-25-22)19(28)12-27/h3-11,19,27-28H,12H2,1-2H3,(H,25,26,29)