(E)-N-tert-butyl-3-[6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-5-yl]prop-2-enamide

Systemtic Name: (E)-N-tert-butyl-3-[6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-5-yl]prop-2-enamide Openeye Name: (E)-N-tert-butyl-3-[6-methyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinolin-5-yl]prop-2-enamide CAS Name: (E)-N-tert-butyl-3-[6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-5-yl]-2-propenamide IUPAC Name: (E)-N-tert-butyl-3-[6-methyl-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-5-yl]prop-2-enamide Traditional Name: (E)-N-tert-butyl-3-(6-methyl-2-tosyl-3,4-dihydro-1H-isoquinolin-5-yl)acrylamide Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=CC(=C3C=CC(=O)NC(C)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC3=C(C2)C=CC(=C3/C=C/C(=O)NC(C)(C)C)C

InChI

InChI=1S/C24H30N2O3S/c1-17-6-10-20(11-7-17)30(28,29)26-15-14-22-19(16-26)9-8-18(2)21(22)12-13-23(27)25-24(3,4)5/h6-13H,14-16H2,1-5H3,(H,25,27)/b13-12+