N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-1-thiophen-2-yl-cyclopentane-1-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-1-thiophen-2-yl-cyclopentane-1-carboxamide Openeye Name: N-[2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-1-(2-thienyl)cyclopentanecarboxamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-1-thiophen-2-yl-1-cyclopentanecarboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-1-thiophen-2-ylcyclopentane-1-carboxamide Traditional Name: 1-(2-thienyl)-N-(2-tosyl-3,4-dihydro-1H-isoquinolin-7-yl)cyclopentanecarboxamide Formula: C26H28N2O3S2 MolecularWeight: 480.64212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4(CCCC4)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4(CCCC4)C5=CC=CS5

InChI

InChI=1S/C26H28N2O3S2/c1-19-6-10-23(11-7-19)33(30,31)28-15-12-20-8-9-22(17-21(20)18-28)27-25(29)26(13-2-3-14-26)24-5-4-16-32-24/h4-11,16-17H,2-3,12-15,18H2,1H3,(H,27,29)