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

Systemtic Name: N-(2-imidazol-1-ylethyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-(2-imidazol-1-ylethyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-[2-(1-imidazolyl)ethyl]-4-(1H-indazol-5-ylamino)-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-(2-imidazol-1-ylethyl)-4-(1H-indazol-5-ylamino)-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(2-imidazol-1-ylethyl)-4-(1H-indazol-5-ylamino)-2-(methylthio)pyrimidine-5-carboxamide Formula: C18H18N8OS MolecularWeight: 394.45352

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCCN4C=CN=C4

Isomeric SMILES

CSC1=NC=C(C(=N1)NC2=CC3=C(C=C2)NN=C3)C(=O)NCCN4C=CN=C4

InChI

InChI=1S/C18H18N8OS/c1-28-18-21-10-14(17(27)20-5-7-26-6-4-19-11-26)16(24-18)23-13-2-3-15-12(8-13)9-22-25-15/h2-4,6,8-11H,5,7H2,1H3,(H,20,27)(H,22,25)(H,21,23,24)