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

Systemtic Name: N6-(2-methoxyethyl)-N4-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholin-2-ylsulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: N6-(2-methoxyethyl)-N4-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholin-2-ylsulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine CAS Name: N6-(2-methoxyethyl)-N4-(5-methyl-1H-pyrazol-3-yl)-2-[[4-(2-morpholinylsulfonyl)phenyl]methylthio]pyrimidine-4,6-diamine IUPAC Name: 6-N-(2-methoxyethyl)-4-N-(5-methyl-1H-pyrazol-3-yl)-2-[(4-morpholin-2-ylsulfonylphenyl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: 2-methoxyethyl-[6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-[(4-morpholin-2-ylsulfonylbenzyl)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)C4CNCCO4)NCCOC

Isomeric SMILES

CC1=CC(=NN1)NC2=CC(=NC(=N2)SCC3=CC=C(C=C3)S(=O)(=O)C4CNCCO4)NCCOC

InChI

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