4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine

Systemtic Name: 4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine Openeye Name: 4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)-N-(m-tolyl)pyrimidin-2-amine CAS Name: 4-[5-methyl-3-(methylthio)-1-phenyl-4-pyrazolyl]-N-(3-methylphenyl)-2-pyrimidinamine IUPAC Name: 4-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)-N-(3-methylphenyl)pyrimidin-2-amine Traditional Name: [4-[5-methyl-3-(methylthio)-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]-(m-tolyl)amine Formula: C22H21N5S MolecularWeight: 387.50064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=C(N(N=C3SC)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=CC(=N2)C3=C(N(N=C3SC)C4=CC=CC=C4)C

InChI

InChI=1S/C22H21N5S/c1-15-8-7-9-17(14-15)24-22-23-13-12-19(25-22)20-16(2)27(26-21(20)28-3)18-10-5-4-6-11-18/h4-14H,1-3H3,(H,23,24,25)