2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone CAS Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-1-(1-methylsulfonyl-3,4-dihydro-2H-quinolin-6-yl)ethanone Traditional Name: 1-(1-mesyl-3,4-dihydro-2H-quinolin-6-yl)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]ethanone Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)C3=CC4=C(C=C3)N(CCC4)S(=O)(=O)C

InChI

InChI=1S/C20H21N3O4S2/c1-27-15-6-7-16-17(11-15)22-20(21-16)28-12-19(24)14-5-8-18-13(10-14)4-3-9-23(18)29(2,25)26/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,21,22)