N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-oxobutan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S)-1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2-methyl-propyl]-4-methyl-benzenesulfonamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H26N2O3S/c1-15(2)20(22-27(25,26)19-10-8-16(3)9-11-19)21(24)23-13-12-17-6-4-5-7-18(17)14-23/h4-11,15,20,22H,12-14H2,1-3H3/t20-/m0/s1