N-[4-bromanyl-3-(2-chlorophenyl)carbonyl-phenyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: N-[4-bromanyl-3-(2-chlorophenyl)carbonyl-phenyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: N-[4-bromo-3-(2-chlorobenzoyl)phenyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: N-[4-bromo-3-[(2-chlorophenyl)-oxomethyl]phenyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: N-[4-bromo-3-(2-chlorobenzoyl)phenyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: N-[4-bromo-3-(2-chlorobenzoyl)phenyl]-4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C29H22BrClN2O4S MolecularWeight: 609.91798

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)Br)C(=O)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)Br)C(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C29H22BrClN2O4S/c30-26-14-11-22(17-25(26)28(34)24-7-3-4-8-27(24)31)32-29(35)20-9-12-23(13-10-20)38(36,37)33-16-15-19-5-1-2-6-21(19)18-33/h1-14,17H,15-16,18H2,(H,32,35)