N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-2-yl]-2-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-2-yl]-2-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2,2-dimethyl-propyl]-2-(p-tolylsulfonylamino)propanamide CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-2-yl]-2-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-2-yl]-2-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2,2-dimethyl-propyl]-2-(tosylamino)propionamide Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC(CN2CCC3=CC=CC=C3C2)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC(CN2CCC3=CC=CC=C3C2)C(C)(C)C

InChI

InChI=1S/C25H35N3O3S/c1-18-10-12-22(13-11-18)32(30,31)27-19(2)24(29)26-23(25(3,4)5)17-28-15-14-20-8-6-7-9-21(20)16-28/h6-13,19,23,27H,14-17H2,1-5H3,(H,26,29)