N4-(2-methoxyethyl)-N6-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholin-4-ylsulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: N4-(2-methoxyethyl)-N6-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholin-4-ylsulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: N4-(2-methoxyethyl)-N6-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholinosulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine CAS Name: N4-(2-methoxyethyl)-N6-(5-methyl-1H-pyrazol-3-yl)-2-[[4-(4-morpholinylsulfonyl)phenyl]methylthio]pyrimidine-4,6-diamine IUPAC Name: 4-N-(2-methoxyethyl)-6-N-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholin-4-ylsulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: 2-methoxyethyl-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(4-morpholinosulfonylbenzyl)thio]pyrimidin-4-yl]amine Formula: C22H29N7O4S2 MolecularWeight: 519.64016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=CC(=NC(=N2)SCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)NCCOC

Isomeric SMILES

CC1=CC(=NN1)NC2=CC(=NC(=N2)SCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)NCCOC

InChI

InChI=1S/C22H29N7O4S2/c1-16-13-21(28-27-16)24-20-14-19(23-7-10-32-2)25-22(26-20)34-15-17-3-5-18(6-4-17)35(30,31)29-8-11-33-12-9-29/h3-6,13-14H,7-12,15H2,1-2H3,(H3,23,24,25,26,27,28)