[1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]-(2-naphthalen-2-ylethyl)azanium

Systemtic Name: [1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-yl]-(2-naphthalen-2-ylethyl)azanium Openeye Name: [1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-4-piperidyl]-[2-(2-naphthyl)ethyl]ammonium CAS Name: [1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinyl]-[2-(2-naphthalenyl)ethyl]ammonium IUPAC Name: [1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidin-4-yl]-(2-naphthalen-2-ylethyl)azanium Traditional Name: [1-(7-mesyl-4-methyl-quinazolin-2-yl)-4-piperidyl]-[2-(2-naphthyl)ethyl]ammonium Formula: C27H31N4O2S+ MolecularWeight: 475.62564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)[NH2+]CCC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)[NH2+]CCC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H30N4O2S/c1-19-25-10-9-24(34(2,32)33)18-26(25)30-27(29-19)31-15-12-23(13-16-31)28-14-11-20-7-8-21-5-3-4-6-22(21)17-20/h3-10,17-18,23,28H,11-16H2,1-2H3/p+1