5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-4-yl-thiophene-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-4-yl-thiophene-3-carboxamide Openeye Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-pyridyl)thiophene-3-carboxamide CAS Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-4-yl-3-thiophenecarboxamide IUPAC Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-pyridin-4-ylthiophene-3-carboxamide Traditional Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-pyridyl)thiophene-3-carboxamide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=CS3)C(=O)NC4=CC=NC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC(=CS3)C(=O)NC4=CC=NC=C4

InChI

InChI=1S/C19H17N3O3S2/c23-19(21-17-5-8-20-9-6-17)16-11-18(26-13-16)27(24,25)22-10-7-14-3-1-2-4-15(14)12-22/h1-6,8-9,11,13H,7,10,12H2,(H,20,21,23)