2-[[4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyridin-3-yl]methyl]pyrimidine-5-carboxamide

Systemtic Name: 2-[[4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyridin-3-yl]methyl]pyrimidine-5-carboxamide Openeye Name: 2-[[4-(1H-indazol-5-ylamino)-2-methylsulfanyl-3-pyridyl]methyl]pyrimidine-5-carboxamide CAS Name: 2-[[4-(1H-indazol-5-ylamino)-2-(methylthio)-3-pyridinyl]methyl]-5-pyrimidinecarboxamide IUPAC Name: 2-[[4-(1H-indazol-5-ylamino)-2-methylsulfanylpyridin-3-yl]methyl]pyrimidine-5-carboxamide Traditional Name: 2-[[4-(1H-indazol-5-ylamino)-2-(methylthio)-3-pyridyl]methyl]pyrimidine-5-carboxamide Formula: C19H17N7OS MolecularWeight: 391.44958

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=C1CC2=NC=C(C=N2)C(=O)N)NC3=CC4=C(C=C3)NN=C4

Isomeric SMILES

CSC1=NC=CC(=C1CC2=NC=C(C=N2)C(=O)N)NC3=CC4=C(C=C3)NN=C4

InChI

InChI=1S/C19H17N7OS/c1-28-19-14(7-17-22-8-12(9-23-17)18(20)27)16(4-5-21-19)25-13-2-3-15-11(6-13)10-24-26-15/h2-6,8-10H,7H2,1H3,(H2,20,27)(H,21,25)(H,24,26)