5-bromanyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]thiophene-2-sulfonamide Formula: C16H17BrN2O3S2 MolecularWeight: 429.35178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CCNS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CCNS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H17BrN2O3S2/c17-14-5-6-16(23-14)24(21,22)18-9-7-15(20)19-10-8-12-3-1-2-4-13(12)11-19/h1-6,18H,7-11H2