2-(3-methylphenyl)sulfonyl-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(3-methylphenyl)sulfonyl-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline Openeye Name: 1-(1-methylpyrrolidin-2-yl)-2-(m-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(3-methylphenyl)sulfonyl-1-(1-methyl-2-pyrrolidinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(3-methylphenyl)sulfonyl-1-(1-methylpyrrolidin-2-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: 1-(1-methylpyrrolidin-2-yl)-2-(m-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2C4CCCN4C

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)N2CCC3=CC=CC=C3C2C4CCCN4C

InChI

InChI=1S/C21H26N2O2S/c1-16-7-5-9-18(15-16)26(24,25)23-14-12-17-8-3-4-10-19(17)21(23)20-11-6-13-22(20)2/h3-5,7-10,15,20-21H,6,11-14H2,1-2H3