4-(5-azanyl-3-phenylazanyl-1,2,4-triazol-1-yl)-6-phenylazanyl-pyrimidine-2-carboxamide

Systemtic Name: 4-(5-azanyl-3-phenylazanyl-1,2,4-triazol-1-yl)-6-phenylazanyl-pyrimidine-2-carboxamide Openeye Name: 4-(5-amino-3-anilino-1,2,4-triazol-1-yl)-6-anilino-pyrimidine-2-carboxamide CAS Name: 4-(5-amino-3-anilino-1,2,4-triazol-1-yl)-6-anilino-2-pyrimidinecarboxamide IUPAC Name: 4-(5-amino-3-anilino-1,2,4-triazol-1-yl)-6-anilinopyrimidine-2-carboxamide Traditional Name: 4-(5-amino-3-anilino-1,2,4-triazol-1-yl)-6-anilino-pyrimidine-2-carboxamide Formula: C19H17N9O MolecularWeight: 387.39798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=C2)N3C(=NC(=N3)NC4=CC=CC=C4)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=C2)N3C(=NC(=N3)NC4=CC=CC=C4)N)C(=O)N

InChI

InChI=1S/C19H17N9O/c20-16(29)17-24-14(22-12-7-3-1-4-8-12)11-15(25-17)28-18(21)26-19(27-28)23-13-9-5-2-6-10-13/h1-11H,(H2,20,29)(H,22,24,25)(H3,21,23,26,27)