4-chloranyl-N-(3-cyanothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: 4-chloranyl-N-(3-cyanothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: 4-chloro-N-(3-cyano-2-thienyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: 4-chloro-N-(3-cyano-2-thiophenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: 4-chloro-N-(3-cyanothiophen-2-yl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: 4-chloro-N-(3-cyano-2-thienyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C21H16ClN3O3S2 MolecularWeight: 457.95304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=C(C=CS4)C#N)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)NC4=C(C=CS4)C#N)Cl

InChI

InChI=1S/C21H16ClN3O3S2/c22-18-6-5-15(20(26)24-21-16(12-23)8-10-29-21)11-19(18)30(27,28)25-9-7-14-3-1-2-4-17(14)13-25/h1-6,8,10-11H,7,9,13H2,(H,24,26)