butan-1-amine; 5-phenyl-1H-1,2,4-triazole

Systemtic Name: butan-1-amine; 5-phenyl-1H-1,2,4-triazole Openeye Name: butan-1-amine; 5-phenyl-1H-1,2,4-triazole CAS Name: 1-butanamine; 5-phenyl-1H-1,2,4-triazole IUPAC Name: butan-1-amine; 5-phenyl-1H-1,2,4-triazole Traditional Name: butylamine; 5-phenyl-1H-1,2,4-triazole Formula: C12H18N4 MolecularWeight: 218.29812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN.C1=CC=C(C=C1)C2=NC=NN2

Isomeric SMILES

CCCCN.C1=CC=C(C=C1)C2=NC=NN2

InChI

InChI=1S/C8H7N3.C4H11N/c1-2-4-7(5-3-1)8-9-6-10-11-8;1-2-3-4-5/h1-6H,(H,9,10,11);2-5H2,1H3