5-methyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N4-(3-propylsulfonylphenyl)pyrimidine-2,4-diamine

Systemtic Name: 5-methyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N4-(3-propylsulfonylphenyl)pyrimidine-2,4-diamine Openeye Name: 5-methyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N4-(3-propylsulfonylphenyl)pyrimidine-2,4-diamine CAS Name: 5-methyl-N2-[4-(4-methyl-1-piperazinyl)phenyl]-N4-(3-propylsulfonylphenyl)pyrimidine-2,4-diamine IUPAC Name: 5-methyl-2-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-N-(3-propylsulfonylphenyl)pyrimidine-2,4-diamine Traditional Name: [5-methyl-2-[4-(4-methylpiperazino)anilino]pyrimidin-4-yl]-(3-propylsulfonylphenyl)amine Formula: C25H32N6O2S MolecularWeight: 480.62558

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC(=C1)NC2=NC(=NC=C2C)NC3=CC=C(C=C3)N4CCN(CC4)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC(=C1)NC2=NC(=NC=C2C)NC3=CC=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C25H32N6O2S/c1-4-16-34(32,33)23-7-5-6-21(17-23)27-24-19(2)18-26-25(29-24)28-20-8-10-22(11-9-20)31-14-12-30(3)13-15-31/h5-11,17-18H,4,12-16H2,1-3H3,(H2,26,27,28,29)