4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(3-pyridylmethyl)pyrimidine-5-carboxamide CAS Name: 4-(1H-indazol-5-ylamino)-2-(methylthio)-N-(3-pyridinylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(pyridin-3-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 4-(1H-indazol-5-ylamino)-2-(methylthio)-N-(3-pyridylmethyl)pyrimidine-5-carboxamide Formula: C19H17N7OS MolecularWeight: 391.44958

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCC4=CN=CC=C4

InChI

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