2-[(3-chlorophenyl)methylsulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)-6-piperidin-1-yl-pyrimidin-4-amine

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)-6-piperidin-1-yl-pyrimidin-4-amine Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)-6-(1-piperidyl)pyrimidin-4-amine CAS Name: 2-[(3-chlorophenyl)methylthio]-N-(5-methyl-1H-pyrazol-3-yl)-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: [2-[(3-chlorobenzyl)thio]-6-piperidino-pyrimidin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C20H23ClN6S MolecularWeight: 414.95482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC(=C2)N3CCCCC3)SCC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC(=C2)N3CCCCC3)SCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H23ClN6S/c1-14-10-18(26-25-14)22-17-12-19(27-8-3-2-4-9-27)24-20(23-17)28-13-15-6-5-7-16(21)11-15/h5-7,10-12H,2-4,8-9,13H2,1H3,(H2,22,23,24,25,26)