2-(4-methylphenyl)sulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-methylphenyl)sulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-(4-phenoxyphenyl)-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-methylphenyl)sulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-methylphenyl)sulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-(4-phenoxyphenyl)-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H26N2O4S/c1-21-11-17-27(18-12-21)36(33,34)31-20-23-8-6-5-7-22(23)19-28(31)29(32)30-24-13-15-26(16-14-24)35-25-9-3-2-4-10-25/h2-18,28H,19-20H2,1H3,(H,30,32)