[4-[[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]phenyl]-phenyl-methanone

Systemtic Name: [4-[[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]phenyl]-phenyl-methanone Openeye Name: [4-[[4-(5-methyl-3-methylsulfanyl-1-phenyl-pyrazol-4-yl)pyrimidin-2-yl]amino]phenyl]-phenyl-methanone CAS Name: [4-[[4-[5-methyl-3-(methylthio)-1-phenyl-4-pyrazolyl]-2-pyrimidinyl]amino]phenyl]-phenylmethanone IUPAC Name: [4-[[4-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)pyrimidin-2-yl]amino]phenyl]-phenylmethanone Traditional Name: [4-[[4-[5-methyl-3-(methylthio)-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]amino]phenyl]-phenyl-methanone Formula: C28H23N5OS MolecularWeight: 477.58012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SC)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H23N5OS/c1-19-25(27(35-2)32-33(19)23-11-7-4-8-12-23)24-17-18-29-28(31-24)30-22-15-13-21(14-16-22)26(34)20-9-5-3-6-10-20/h3-18H,1-2H3,(H,29,30,31)