4-(5-azanyl-4-phenyl-pyrazol-1-yl)-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine

Systemtic Name: 4-(5-azanyl-4-phenyl-pyrazol-1-yl)-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine Openeye Name: 4-(5-amino-4-phenyl-pyrazol-1-yl)-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine CAS Name: 4-(5-amino-4-phenyl-1-pyrazolyl)-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine IUPAC Name: 4-(5-amino-4-phenylpyrazol-1-yl)-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine Traditional Name: [4-(5-amino-4-phenyl-pyrazol-1-yl)-s-triazin-2-yl]-(3,4,5-trimethoxyphenyl)amine Formula: C21H21N7O3 MolecularWeight: 419.43654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=NC(=N2)N3C(=C(C=N3)C4=CC=CC=C4)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=NC(=N2)N3C(=C(C=N3)C4=CC=CC=C4)N

InChI

InChI=1S/C21H21N7O3/c1-29-16-9-14(10-17(30-2)18(16)31-3)26-20-23-12-24-21(27-20)28-19(22)15(11-25-28)13-7-5-4-6-8-13/h4-12H,22H2,1-3H3,(H,23,24,26,27)