2-(3,4-dimethoxyphenyl)sulfonyl-N-(4-phenylbutyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(4-phenylbutyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(4-phenylbutyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(4-phenylbutyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(4-phenylbutyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(4-phenylbutyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C28H32N2O5S MolecularWeight: 508.62908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2C(=O)NCCCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2C(=O)NCCCCC4=CC=CC=C4)OC

InChI

InChI=1S/C28H32N2O5S/c1-34-25-16-15-23(20-26(25)35-2)36(32,33)30-19-17-22-13-6-7-14-24(22)27(30)28(31)29-18-9-8-12-21-10-4-3-5-11-21/h3-7,10-11,13-16,20,27H,8-9,12,17-19H2,1-2H3,(H,29,31)