(3R)-2-(4-bromanyl-3-methyl-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-(4-bromanyl-3-methyl-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-(4-bromo-3-methyl-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-(4-bromo-3-methylphenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-(4-bromo-3-methylphenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-(4-bromo-3-methyl-phenyl)sulfonyl-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H19BrN2O3S MolecularWeight: 423.32406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)NC)Br

InChI

InChI=1S/C18H19BrN2O3S/c1-12-9-15(7-8-16(12)19)25(23,24)21-11-14-6-4-3-5-13(14)10-17(21)18(22)20-2/h3-9,17H,10-11H2,1-2H3,(H,20,22)/t17-/m1/s1