N4-methyl-N4-(3-methyl-2H-indazol-6-yl)-N2-(3-methylsulfinylphenyl)pyrimidine-2,4-diamine

Systemtic Name: N4-methyl-N4-(3-methyl-2H-indazol-6-yl)-N2-(3-methylsulfinylphenyl)pyrimidine-2,4-diamine Openeye Name: N4-methyl-N4-(3-methyl-2H-indazol-6-yl)-N2-(3-methylsulfinylphenyl)pyrimidine-2,4-diamine CAS Name: N4-methyl-N4-(3-methyl-2H-indazol-6-yl)-N2-(3-methylsulfinylphenyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-methyl-4-N-(3-methyl-2H-indazol-6-yl)-2-N-(3-methylsulfinylphenyl)pyrimidine-2,4-diamine Traditional Name: methyl-(3-methyl-2H-indazol-6-yl)-[2-(3-methylsulfinylanilino)pyrimidin-4-yl]amine Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=CC2=NN1)N(C)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)C

Isomeric SMILES

CC1=C2C=CC(=CC2=NN1)N(C)C3=NC(=NC=C3)NC4=CC(=CC=C4)S(=O)C

InChI

InChI=1S/C20H20N6OS/c1-13-17-8-7-15(12-18(17)25-24-13)26(2)19-9-10-21-20(23-19)22-14-5-4-6-16(11-14)28(3)27/h4-12H,1-3H3,(H,24,25)(H,21,22,23)