4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(2-morpholin-4-ylethyl)pyrimidine-5-carboxamide

Systemtic Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(2-morpholin-4-ylethyl)pyrimidine-5-carboxamide Openeye Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(2-morpholinoethyl)pyrimidine-5-carboxamide CAS Name: 4-(1H-indazol-5-ylamino)-2-(methylthio)-N-[2-(4-morpholinyl)ethyl]-5-pyrimidinecarboxamide IUPAC Name: 4-(1H-indazol-5-ylamino)-2-methylsulfanyl-N-(2-morpholin-4-ylethyl)pyrimidine-5-carboxamide Traditional Name: 4-(1H-indazol-5-ylamino)-2-(methylthio)-N-(2-morpholinoethyl)pyrimidine-5-carboxamide Formula: C19H23N7O2S MolecularWeight: 413.49662

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCCN4CCOCC4

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCCN4CCOCC4

InChI

InChI=1S/C19H23N7O2S/c1-29-19-21-12-15(18(27)20-4-5-26-6-8-28-9-7-26)17(24-19)23-14-2-3-16-13(10-14)11-22-25-16/h2-3,10-12H,4-9H2,1H3,(H,20,27)(H,22,25)(H,21,23,24)