4-(3-azanyl-1H-1,2,4-triazol-5-yl)-N-[(4-tert-butylphenyl)methyl]pyridin-2-amine

Systemtic Name: 4-(3-azanyl-1H-1,2,4-triazol-5-yl)-N-[(4-tert-butylphenyl)methyl]pyridin-2-amine Openeye Name: 4-(3-amino-1H-1,2,4-triazol-5-yl)-N-[(4-tert-butylphenyl)methyl]pyridin-2-amine CAS Name: 4-(3-amino-1H-1,2,4-triazol-5-yl)-N-[(4-tert-butylphenyl)methyl]-2-pyridinamine IUPAC Name: 4-(3-amino-1H-1,2,4-triazol-5-yl)-N-[(4-tert-butylphenyl)methyl]pyridin-2-amine Traditional Name: [4-(3-amino-1H-1,2,4-triazol-5-yl)-2-pyridyl]-(4-tert-butylbenzyl)amine Formula: C18H22N6 MolecularWeight: 322.40748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC2=NC=CC(=C2)C3=NC(=NN3)N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC2=NC=CC(=C2)C3=NC(=NN3)N

InChI

InChI=1S/C18H22N6/c1-18(2,3)14-6-4-12(5-7-14)11-21-15-10-13(8-9-20-15)16-22-17(19)24-23-16/h4-10H,11H2,1-3H3,(H,20,21)(H3,19,22,23,24)