6-[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide Openeye Name: 6-[(1R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-methyl-2-oxo-ethyl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide CAS Name: 6-[[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]thio]-N,N-dimethyl-3-pyridinesulfonamide IUPAC Name: 6-[(2R)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl]sulfanyl-N,N-dimethylpyridine-3-sulfonamide Traditional Name: 6-[[(1R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-methyl-ethyl]thio]-N,N-dimethyl-pyridine-3-sulfonamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C2C1)SC3=NC=C(C=C3)S(=O)(=O)N(C)C

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C2C1)SC3=NC=C(C=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C19H23N3O3S2/c1-14(19(23)22-11-10-15-6-4-5-7-16(15)13-22)26-18-9-8-17(12-20-18)27(24,25)21(2)3/h4-9,12,14H,10-11,13H2,1-3H3/t14-/m1/s1