4-tert-butyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]cyclohexane-1-carboxamide

Systemtic Name: 4-tert-butyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]cyclohexane-1-carboxamide Openeye Name: 4-tert-butyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]cyclohexanecarboxamide CAS Name: 4-tert-butyl-N-[4-[[1-oxo-2-(1,2,4-triazol-1-yl)propyl]amino]phenyl]-1-cyclohexanecarboxamide IUPAC Name: 4-tert-butyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]cyclohexane-1-carboxamide Traditional Name: 4-tert-butyl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]cyclohexanecarboxamide Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2CCC(CC2)C(C)(C)C)N3C=NC=N3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)NC(=O)C2CCC(CC2)C(C)(C)C)N3C=NC=N3

InChI

InChI=1S/C22H31N5O2/c1-15(27-14-23-13-24-27)20(28)25-18-9-11-19(12-10-18)26-21(29)16-5-7-17(8-6-16)22(2,3)4/h9-17H,5-8H2,1-4H3,(H,25,28)(H,26,29)