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

Systemtic Name: 2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-imidazol-1-ylphenyl)benzamide Openeye Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-imidazol-1-ylphenyl)benzamide CAS Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(1-imidazolyl)phenyl]benzamide IUPAC Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-imidazol-1-ylphenyl)benzamide Traditional Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-imidazol-1-ylphenyl)benzamide Formula: C25H21ClN4O3S MolecularWeight: 492.97724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NC4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)NC4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C25H21ClN4O3S/c26-24-10-9-22(34(32,33)30-13-11-18-3-1-2-4-19(18)16-30)15-23(24)25(31)28-20-5-7-21(8-6-20)29-14-12-27-17-29/h1-10,12,14-15,17H,11,13,16H2,(H,28,31)