5-(4-bromophenyl)sulfanyl-6-methoxy-2-methylsulfonyl-quinoline

Systemtic Name: 5-(4-bromophenyl)sulfanyl-6-methoxy-2-methylsulfonyl-quinoline Openeye Name: 5-(4-bromophenyl)sulfanyl-6-methoxy-2-methylsulfonyl-quinoline CAS Name: 5-[(4-bromophenyl)thio]-6-methoxy-2-methylsulfonylquinoline IUPAC Name: 5-(4-bromophenyl)sulfanyl-6-methoxy-2-methylsulfonylquinoline Traditional Name: 5-[(4-bromophenyl)thio]-2-mesyl-6-methoxy-quinoline Formula: C17H14BrNO3S2 MolecularWeight: 424.33196

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N=C(C=C2)S(=O)(=O)C)SC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C2=C(C=C1)N=C(C=C2)S(=O)(=O)C)SC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H14BrNO3S2/c1-22-15-9-8-14-13(7-10-16(19-14)24(2,20)21)17(15)23-12-5-3-11(18)4-6-12/h3-10H,1-2H3