1-[4-tert-butyl-2,3-bis(4-chlorophenyl)-3H-1,2,4-triazol-5-yl]ethanone

Systemtic Name: 1-[4-tert-butyl-2,3-bis(4-chlorophenyl)-3H-1,2,4-triazol-5-yl]ethanone Openeye Name: 1-[4-tert-butyl-2,3-bis(4-chlorophenyl)-3H-1,2,4-triazol-5-yl]ethanone CAS Name: 1-[4-tert-butyl-2,3-bis(4-chlorophenyl)-3H-1,2,4-triazol-5-yl]ethanone IUPAC Name: 1-[4-tert-butyl-2,3-bis(4-chlorophenyl)-3H-1,2,4-triazol-5-yl]ethanone Traditional Name: 1-[4-tert-butyl-2,3-bis(4-chlorophenyl)-3H-1,2,4-triazol-5-yl]ethanone Formula: C20H21Cl2N3O MolecularWeight: 390.30624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(N1C(C)(C)C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=NN(C(N1C(C)(C)C)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21Cl2N3O/c1-13(26)18-23-25(17-11-9-16(22)10-12-17)19(24(18)20(2,3)4)14-5-7-15(21)8-6-14/h5-12,19H,1-4H3