4-methoxy-1-(phenylsulfonyl)-3-[(4-pyridin-3-ylphenyl)methyl]indole

Systemtic Name: 4-methoxy-1-(phenylsulfonyl)-3-[(4-pyridin-3-ylphenyl)methyl]indole Openeye Name: 1-(benzenesulfonyl)-4-methoxy-3-[[4-(3-pyridyl)phenyl]methyl]indole CAS Name: 1-(benzenesulfonyl)-4-methoxy-3-[[4-(3-pyridinyl)phenyl]methyl]indole IUPAC Name: 1-(benzenesulfonyl)-4-methoxy-3-[(4-pyridin-3-ylphenyl)methyl]indole Traditional Name: 1-besyl-4-methoxy-3-[4-(3-pyridyl)benzyl]indole Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=CN2S(=O)(=O)C3=CC=CC=C3)CC4=CC=C(C=C4)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=CC2=C1C(=CN2S(=O)(=O)C3=CC=CC=C3)CC4=CC=C(C=C4)C5=CN=CC=C5

InChI

InChI=1S/C27H22N2O3S/c1-32-26-11-5-10-25-27(26)23(19-29(25)33(30,31)24-8-3-2-4-9-24)17-20-12-14-21(15-13-20)22-7-6-16-28-18-22/h2-16,18-19H,17H2,1H3