N-(3-imidazol-1-ylpropyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-4-(1H-indazol-5-ylamino)-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-4-(1H-indazol-5-ylamino)-2-(methylthio)pyrimidine-5-carboxamide Formula: C19H20N8OS MolecularWeight: 408.4801

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C19H20N8OS/c1-29-19-22-11-15(18(28)21-5-2-7-27-8-6-20-12-27)17(25-19)24-14-3-4-16-13(9-14)10-23-26-16/h3-4,6,8-12H,2,5,7H2,1H3,(H,21,28)(H,23,26)(H,22,24,25)