2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-methylthiophen-2-yl)methyl]benzamide

Systemtic Name: 2-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-methylthiophen-2-yl)methyl]benzamide Openeye Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-methyl-2-thienyl)methyl]benzamide CAS Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-methyl-2-thiophenyl)methyl]benzamide IUPAC Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-methylthiophen-2-yl)methyl]benzamide Traditional Name: 2-chloro-5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[(3-methyl-2-thienyl)methyl]benzamide Formula: C22H21ClN2O3S2 MolecularWeight: 460.99674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC4=CC=CC=C4C3)Cl

InChI

InChI=1S/C22H21ClN2O3S2/c1-15-9-11-29-21(15)13-24-22(26)19-12-18(6-7-20(19)23)30(27,28)25-10-8-16-4-2-3-5-17(16)14-25/h2-7,9,11-12H,8,10,13-14H2,1H3,(H,24,26)