4-[5-[[methyl-(phenylmethyl)amino]methyl]-3-methylsulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyridin-2-amine

Systemtic Name: 4-[5-[[methyl-(phenylmethyl)amino]methyl]-3-methylsulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyridin-2-amine Openeye Name: 4-[5-[[benzyl(methyl)amino]methyl]-3-methylsulfanyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyridin-2-amine CAS Name: 4-[5-[[methyl-(phenylmethyl)amino]methyl]-3-(methylthio)-1-phenyl-4-pyrazolyl]-N-phenyl-2-pyridinamine IUPAC Name: 4-[5-[[benzyl(methyl)amino]methyl]-3-methylsulfanyl-1-phenylpyrazol-4-yl]-N-phenylpyridin-2-amine Traditional Name: [4-(2-anilino-4-pyridyl)-5-(methylthio)-2-phenyl-pyrazol-3-yl]methyl-benzyl-methyl-amine Formula: C30H29N5S MolecularWeight: 491.64976

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)CC2=C(C(=NN2C3=CC=CC=C3)SC)C4=CC(=NC=C4)NC5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1)CC2=C(C(=NN2C3=CC=CC=C3)SC)C4=CC(=NC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C30H29N5S/c1-34(21-23-12-6-3-7-13-23)22-27-29(30(36-2)33-35(27)26-16-10-5-11-17-26)24-18-19-31-28(20-24)32-25-14-8-4-9-15-25/h3-20H,21-22H2,1-2H3,(H,31,32)