N-(3-pyrazol-1-ylpropyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-amine

Systemtic Name: N-(3-pyrazol-1-ylpropyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-amine Openeye Name: N-(3-pyrazol-1-ylpropyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-amine CAS Name: N-[3-(1-pyrazolyl)propyl]-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-amine IUPAC Name: N-(3-pyrazol-1-ylpropyl)-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-amine Traditional Name: 3-pyrazol-1-ylpropyl-[5-(3,4,5-trimethoxyphenyl)-1,2,4-triazin-3-yl]amine Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CN=NC(=N2)NCCCN3C=CC=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CN=NC(=N2)NCCCN3C=CC=N3

InChI

InChI=1S/C18H22N6O3/c1-25-15-10-13(11-16(26-2)17(15)27-3)14-12-20-23-18(22-14)19-6-4-8-24-9-5-7-21-24/h5,7,9-12H,4,6,8H2,1-3H3,(H,19,22,23)