3-[1-(4-bromanyl-3-methyl-phenyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 3-[1-(4-bromanyl-3-methyl-phenyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine Openeye Name: 3-[1-(4-bromo-3-methyl-phenyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine CAS Name: 3-[1-(4-bromo-3-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 3-[1-(4-bromo-3-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine Traditional Name: 3-[1-(4-bromo-3-methyl-phenyl)sulfonyl-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[2,3-b]pyridine Formula: C19H18BrN3O2S MolecularWeight: 432.33412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(=CC2)C3=CNC4=C3C=CC=N4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(=CC2)C3=CNC4=C3C=CC=N4)Br

InChI

InChI=1S/C19H18BrN3O2S/c1-13-11-15(4-5-18(13)20)26(24,25)23-9-6-14(7-10-23)17-12-22-19-16(17)3-2-8-21-19/h2-6,8,11-12H,7,9-10H2,1H3,(H,21,22)