4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]benzamide CAS Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[2-(dimethylamino)-2-(2-thienyl)ethyl]benzamide Formula: C24H26ClN3O3S2 MolecularWeight: 504.06454

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCC3=CC=CC=C3C2)C4=CC=CS4

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCC3=CC=CC=C3C2)C4=CC=CS4

InChI

InChI=1S/C24H26ClN3O3S2/c1-27(2)21(22-8-5-13-32-22)15-26-24(29)18-9-10-20(25)23(14-18)33(30,31)28-12-11-17-6-3-4-7-19(17)16-28/h3-10,13-14,21H,11-12,15-16H2,1-2H3,(H,26,29)