N-[[3-(3,3-dimethylpiperidin-1-yl)sulfonylphenyl]methyl]-1-(4-methylphenyl)methanamine

Systemtic Name: N-[[3-(3,3-dimethylpiperidin-1-yl)sulfonylphenyl]methyl]-1-(4-methylphenyl)methanamine Openeye Name: N-[[3-[(3,3-dimethyl-1-piperidyl)sulfonyl]phenyl]methyl]-1-(p-tolyl)methanamine CAS Name: N-[[3-[(3,3-dimethyl-1-piperidinyl)sulfonyl]phenyl]methyl]-1-(4-methylphenyl)methanamine IUPAC Name: N-[[3-(3,3-dimethylpiperidin-1-yl)sulfonylphenyl]methyl]-1-(4-methylphenyl)methanamine Traditional Name: [3-(3,3-dimethylpiperidino)sulfonylbenzyl]-(4-methylbenzyl)amine Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNCC2=CC(=CC=C2)S(=O)(=O)N3CCCC(C3)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNCC2=CC(=CC=C2)S(=O)(=O)N3CCCC(C3)(C)C

InChI

InChI=1S/C22H30N2O2S/c1-18-8-10-19(11-9-18)15-23-16-20-6-4-7-21(14-20)27(25,26)24-13-5-12-22(2,3)17-24/h4,6-11,14,23H,5,12-13,15-17H2,1-3H3