2-(2,5-dimethoxyphenyl)sulfonyl-N-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(2,5-dimethoxyphenyl)sulfonyl-N-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(2,5-dimethoxyphenyl)sulfonyl-N-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(2,5-dimethoxyphenyl)sulfonyl-N-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(2,5-dimethoxyphenyl)sulfonyl-N-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(2,5-dimethoxyphenyl)sulfonyl-N-(3-phenylpropyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCCCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCCCC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O5S/c1-33-23-14-15-25(34-2)26(18-23)35(31,32)29-19-22-13-7-6-12-21(22)17-24(29)27(30)28-16-8-11-20-9-4-3-5-10-20/h3-7,9-10,12-15,18,24H,8,11,16-17,19H2,1-2H3,(H,28,30)