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

Systemtic Name: 4-[3-(2-dimethylaminoethylsulfanyl)-5-methyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine Openeye Name: 4-[3-(2-dimethylaminoethylsulfanyl)-5-methyl-1-phenyl-pyrazol-4-yl]-N-phenyl-pyrimidin-2-amine CAS Name: 4-[3-(2-dimethylaminoethylthio)-5-methyl-1-phenyl-4-pyrazolyl]-N-phenyl-2-pyrimidinamine IUPAC Name: 4-[3-(2-dimethylaminoethylsulfanyl)-5-methyl-1-phenylpyrazol-4-yl]-N-phenylpyrimidin-2-amine Traditional Name: 2-[[4-(2-anilinopyrimidin-4-yl)-5-methyl-1-phenyl-pyrazol-3-yl]thio]ethyl-dimethyl-amine Formula: C24H26N6S MolecularWeight: 430.56844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SCCN(C)C)C3=NC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SCCN(C)C)C3=NC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C24H26N6S/c1-18-22(21-14-15-25-24(27-21)26-19-10-6-4-7-11-19)23(31-17-16-29(2)3)28-30(18)20-12-8-5-9-13-20/h4-15H,16-17H2,1-3H3,(H,25,26,27)