4-(1-benzothiophen-7-yl)-1-[3-(4-methylphenyl)sulfonyl-3-phenyl-propyl]-3,6-dihydro-2H-pyridine

Systemtic Name: 4-(1-benzothiophen-7-yl)-1-[3-(4-methylphenyl)sulfonyl-3-phenyl-propyl]-3,6-dihydro-2H-pyridine Openeye Name: 4-(benzothiophen-7-yl)-1-[3-phenyl-3-(p-tolylsulfonyl)propyl]-3,6-dihydro-2H-pyridine CAS Name: 4-(1-benzothiophen-7-yl)-1-[3-(4-methylphenyl)sulfonyl-3-phenylpropyl]-3,6-dihydro-2H-pyridine IUPAC Name: 4-(1-benzothiophen-7-yl)-1-[3-(4-methylphenyl)sulfonyl-3-phenylpropyl]-3,6-dihydro-2H-pyridine Traditional Name: 4-(benzothiophen-7-yl)-1-(3-phenyl-3-tosyl-propyl)-3,6-dihydro-2H-pyridine Formula: C29H29NO2S2 MolecularWeight: 487.67606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CCN2CCC(=CC2)C3=CC=CC4=C3SC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CCN2CCC(=CC2)C3=CC=CC4=C3SC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H29NO2S2/c1-22-10-12-26(13-11-22)34(31,32)28(24-6-3-2-4-7-24)16-20-30-18-14-23(15-19-30)27-9-5-8-25-17-21-33-29(25)27/h2-14,17,21,28H,15-16,18-20H2,1H3