3-[[4-(2H-benzotriazol-4-ylamino)pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-(2H-benzotriazol-4-ylamino)pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-(2H-benzotriazol-4-ylamino)pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-(2H-benzotriazol-4-ylamino)-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-(2H-benzotriazol-4-ylamino)pyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-(2H-benzotriazol-4-ylamino)pyrimidin-2-yl]amino]benzamide Formula: C17H14N8O MolecularWeight: 346.34606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=CC(=N2)NC3=CC=CC4=NNN=C43)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=CC(=N2)NC3=CC=CC4=NNN=C43)C(=O)N

InChI

InChI=1S/C17H14N8O/c18-16(26)10-3-1-4-11(9-10)20-17-19-8-7-14(22-17)21-12-5-2-6-13-15(12)24-25-23-13/h1-9H,(H2,18,26)(H,23,24,25)(H2,19,20,21,22)