N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-phenyl-1,2,4-triazin-3-amine

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-phenyl-1,2,4-triazin-3-amine Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-phenyl-1,2,4-triazin-3-amine CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-phenyl-1,2,4-triazin-3-amine IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-5-phenyl-1,2,4-triazin-3-amine Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(5-phenyl-1,2,4-triazin-3-yl)amine Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC3=NC(=CN=N3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)CNC3=NC(=CN=N3)C4=CC=CC=C4

InChI

InChI=1S/C18H16N4O2/c1-2-6-13(7-3-1)15-11-20-22-18(21-15)19-10-14-12-23-16-8-4-5-9-17(16)24-14/h1-9,11,14H,10,12H2,(H,19,21,22)/t14-/m0/s1