N-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]thiophene-2-sulfonamide CAS Name: N-[4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-2-thiophenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)thiazol-2-yl]thiophene-2-sulfonamide Formula: C17H15N3O3S3 MolecularWeight: 405.5143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CSC(=N3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CSC(=N3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H15N3O3S3/c21-16(20-8-7-12-4-1-2-5-13(12)10-20)14-11-25-17(18-14)19-26(22,23)15-6-3-9-24-15/h1-6,9,11H,7-8,10H2,(H,18,19)