5-tert-butyl-2-(3-iodanylprop-2-ynyl)-4-phenyl-3H-1,2,4-triazole

Systemtic Name: 5-tert-butyl-2-(3-iodanylprop-2-ynyl)-4-phenyl-3H-1,2,4-triazole Openeye Name: 5-tert-butyl-2-(3-iodoprop-2-ynyl)-4-phenyl-3H-1,2,4-triazole CAS Name: 5-tert-butyl-2-(3-iodoprop-2-ynyl)-4-phenyl-3H-1,2,4-triazole IUPAC Name: 5-tert-butyl-2-(3-iodoprop-2-ynyl)-4-phenyl-3H-1,2,4-triazole Traditional Name: 5-tert-butyl-2-(3-iodoprop-2-ynyl)-4-phenyl-3H-1,2,4-triazole Formula: C15H18IN3 MolecularWeight: 367.22799

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(CN1C2=CC=CC=C2)CC#CI

Isomeric SMILES

CC(C)(C)C1=NN(CN1C2=CC=CC=C2)CC#CI

InChI

InChI=1S/C15H18IN3/c1-15(2,3)14-17-18(11-7-10-16)12-19(14)13-8-5-4-6-9-13/h4-6,8-9H,11-12H2,1-3H3