N-[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]quinolin-8-amine

Systemtic Name: N-[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]quinolin-8-amine Openeye Name: N-[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]quinolin-8-amine CAS Name: N-[4-[5-methyl-3-(methylthio)-1-phenyl-4-pyrazolyl]-2-pyrimidinyl]-8-quinolinamine IUPAC Name: N-[4-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)pyrimidin-2-yl]quinolin-8-amine Traditional Name: [4-[5-methyl-3-(methylthio)-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]-(8-quinolyl)amine Formula: C24H20N6S MolecularWeight: 424.5208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=NC(=NC=C3)NC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=NC(=NC=C3)NC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C24H20N6S/c1-16-21(23(31-2)29-30(16)18-10-4-3-5-11-18)19-13-15-26-24(27-19)28-20-12-6-8-17-9-7-14-25-22(17)20/h3-15H,1-2H3,(H,26,27,28)