6-chloranyl-N4-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-N4-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 6-chloro-N4-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 6-chloro-N4-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 6-chloro-4-N-[[3-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-[3-(1,2,4-triazol-1-ylmethyl)benzyl]amine Formula: C14H14ClN7 MolecularWeight: 315.76086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC2=CC(=NC(=N2)N)Cl)CN3C=NC=N3

Isomeric SMILES

C1=CC(=CC(=C1)CNC2=CC(=NC(=N2)N)Cl)CN3C=NC=N3

InChI

InChI=1S/C14H14ClN7/c15-12-5-13(21-14(16)20-12)18-6-10-2-1-3-11(4-10)7-22-9-17-8-19-22/h1-5,8-9H,6-7H2,(H3,16,18,20,21)