N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(2,4,6-trimethylphenyl)methanesulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-(2,4,6-trimethylphenyl)methanesulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(2,4,6-trimethylphenyl)methanesulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,4,6-trimethylphenyl)methanesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-(2,4,6-trimethylphenyl)methanesulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-mesityl-methanesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N(CC(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C)C

InChI

InChI=1S/C21H26N2O3S/c1-15-11-16(2)21(17(3)12-15)23(27(4,25)26)14-20(24)22-10-9-18-7-5-6-8-19(18)13-22/h5-8,11-12H,9-10,13-14H2,1-4H3