5-azanyl-2-[4-(cyclopropylcarbonylamino)phenyl]sulfanyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-N-(2-methylsulfanylethyl)pyrimidine-4-carboxamide

Systemtic Name: 5-azanyl-2-[4-(cyclopropylcarbonylamino)phenyl]sulfanyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-N-(2-methylsulfanylethyl)pyrimidine-4-carboxamide Openeye Name: 5-amino-2-[4-(cyclopropanecarbonylamino)phenyl]sulfanyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-N-(2-methylsulfanylethyl)pyrimidine-4-carboxamide CAS Name: 5-amino-2-[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]thio]-6-[(5-methyl-1H-pyrazol-3-yl)amino]-N-[2-(methylthio)ethyl]-4-pyrimidinecarboxamide IUPAC Name: 5-amino-2-[4-(cyclopropanecarbonylamino)phenyl]sulfanyl-6-[(5-methyl-1H-pyrazol-3-yl)amino]-N-(2-methylsulfanylethyl)pyrimidine-4-carboxamide Traditional Name: 5-amino-2-[[4-(cyclopropanecarbonylamino)phenyl]thio]-6-[(5-methyl-1H-pyrazol-3-yl)amino]-N-[2-(methylthio)ethyl]pyrimidine-4-carboxamide Formula: C22H26N8O2S2 MolecularWeight: 498.62424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC(=C2N)C(=O)NCCSC)SC3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC(=C2N)C(=O)NCCSC)SC3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H26N8O2S2/c1-12-11-16(30-29-12)26-19-17(23)18(21(32)24-9-10-33-2)27-22(28-19)34-15-7-5-14(6-8-15)25-20(31)13-3-4-13/h5-8,11,13H,3-4,9-10,23H2,1-2H3,(H,24,32)(H,25,31)(H2,26,27,28,29,30)