6-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methyl]-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C21H28N8O2S MolecularWeight: 456.56442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CN3C(=C(C(=N3)C)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CN3C(=C(C(=N3)C)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C21H28N8O2S/c1-14-9-5-6-10-17(14)23-21-25-18(24-20(22)26-21)13-29-16(3)19(15(2)27-29)32(30,31)28-11-7-4-8-12-28/h5-6,9-10H,4,7-8,11-13H2,1-3H3,(H3,22,23,24,25,26)