6-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]methyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]methyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]methyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[5-(4-chlorophenyl)-2-phenyl-3-pyrazolyl]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[5-(4-chlorophenyl)-2-phenylpyrazol-3-yl]methyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[5-(4-chlorophenyl)-2-phenyl-pyrazol-3-yl]methyl]-s-triazin-2-yl]amine Formula: C19H16ClN7 MolecularWeight: 377.83024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)CC4=NC(=NC(=N4)N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)Cl)CC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C19H16ClN7/c20-13-8-6-12(7-9-13)16-10-15(11-17-23-18(21)25-19(22)24-17)27(26-16)14-4-2-1-3-5-14/h1-10H,11H2,(H4,21,22,23,24,25)