1-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]-N-[(4-tert-butylphenyl)methyl]-N-propan-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]-N-[(4-tert-butylphenyl)methyl]-N-propan-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-1-(3,5-dichloro-4-hydroxy-phenyl)-N-isopropyl-1,2,4-triazole-3-carboxamide CAS Name: N-[(4-tert-butylphenyl)methyl]-1-(3,5-dichloro-4-hydroxyphenyl)-N-propan-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-1-(3,5-dichloro-4-hydroxyphenyl)-N-propan-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-(4-tert-butylbenzyl)-1-(3,5-dichloro-4-hydroxy-phenyl)-N-isopropyl-1,2,4-triazole-3-carboxamide Formula: C23H26Cl2N4O2 MolecularWeight: 461.38414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=C(C=C1)C(C)(C)C)C(=O)C2=NN(C=N2)C3=CC(=C(C(=C3)Cl)O)Cl

Isomeric SMILES

CC(C)N(CC1=CC=C(C=C1)C(C)(C)C)C(=O)C2=NN(C=N2)C3=CC(=C(C(=C3)Cl)O)Cl

InChI

InChI=1S/C23H26Cl2N4O2/c1-14(2)28(12-15-6-8-16(9-7-15)23(3,4)5)22(31)21-26-13-29(27-21)17-10-18(24)20(30)19(25)11-17/h6-11,13-14,30H,12H2,1-5H3