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

Systemtic Name: 3-methylsulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 3-methylsulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 3-methylsulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 3-methylsulfonyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 3-mesyl-N-(4-phenoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1CC2=CC=CC=C2CN1C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1CC2=CC=CC=C2CN1C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4S/c1-30(27,28)22-15-17-7-5-6-8-18(17)16-25(22)23(26)24-19-11-13-21(14-12-19)29-20-9-3-2-4-10-20/h2-14,22H,15-16H2,1H3,(H,24,26)