2-chloranyl-N-(2,6-diethylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: 2-chloranyl-N-(2,6-diethylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 2-chloro-N-(2,6-diethylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: 2-chloro-N-(2,6-diethylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(2,6-diethylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 2-chloro-N-(2,6-diethylphenyl)-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C26H27ClN2O3S MolecularWeight: 483.02218

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C26H27ClN2O3S/c1-3-18-10-7-11-19(4-2)25(18)28-26(30)23-16-22(12-13-24(23)27)33(31,32)29-15-14-20-8-5-6-9-21(20)17-29/h5-13,16H,3-4,14-15,17H2,1-2H3,(H,28,30)