5-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)-1,2,4-triazin-3-amine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)-1,2,4-triazin-3-amine Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-(3-pyridylmethyl)-1,2,4-triazin-3-amine CAS Name: 5-(1,3-benzodioxol-5-yl)-N-(3-pyridinylmethyl)-1,2,4-triazin-3-amine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-(pyridin-3-ylmethyl)-1,2,4-triazin-3-amine Traditional Name: [5-(1,3-benzodioxol-5-yl)-1,2,4-triazin-3-yl]-(3-pyridylmethyl)amine Formula: C16H13N5O2 MolecularWeight: 307.30672

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CN=NC(=N3)NCC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CN=NC(=N3)NCC4=CN=CC=C4

InChI

InChI=1S/C16H13N5O2/c1-2-11(7-17-5-1)8-18-16-20-13(9-19-21-16)12-3-4-14-15(6-12)23-10-22-14/h1-7,9H,8,10H2,(H,18,20,21)