4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide

Systemtic Name: 4-chloranyl-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide Openeye Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]benzamide CAS Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(2-thiazolylsulfamoyl)phenyl]benzamide IUPAC Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide Traditional Name: 4-chloro-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[4-(thiazol-2-ylsulfamoyl)phenyl]benzamide Formula: C25H21ClN4O5S3 MolecularWeight: 589.10604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CS5)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)NC5=NC=CS5)Cl

InChI

InChI=1S/C25H21ClN4O5S3/c26-22-10-5-18(15-23(22)38(34,35)30-13-11-17-3-1-2-4-19(17)16-30)24(31)28-20-6-8-21(9-7-20)37(32,33)29-25-27-12-14-36-25/h1-10,12,14-15H,11,13,16H2,(H,27,29)(H,28,31)