4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[(4,6-diamino-1,3,5-triazin-2-yl)methoxy]-3-methoxy-benzonitrile CAS Name: 4-[(4,6-diamino-1,3,5-triazin-2-yl)methoxy]-3-methoxybenzonitrile IUPAC Name: 4-[(4,6-diamino-1,3,5-triazin-2-yl)methoxy]-3-methoxybenzonitrile Traditional Name: 4-[(4,6-diamino-s-triazin-2-yl)methoxy]-3-methoxy-benzonitrile Formula: C12H12N6O2 MolecularWeight: 272.26268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCC2=NC(=NC(=N2)N)N

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C12H12N6O2/c1-19-9-4-7(5-13)2-3-8(9)20-6-10-16-11(14)18-12(15)17-10/h2-4H,6H2,1H3,(H4,14,15,16,17,18)