1-[4-[(5-methoxy-2-oxidanyl-phenyl)methylamino]cyclohexyl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[4-[(5-methoxy-2-oxidanyl-phenyl)methylamino]cyclohexyl]-N-(2-methylpropyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[4-[(2-hydroxy-5-methoxy-phenyl)methylamino]cyclohexyl]-N-isobutyl-triazole-4-carboxamide CAS Name: 1-[4-[(2-hydroxy-5-methoxyphenyl)methylamino]cyclohexyl]-N-(2-methylpropyl)-4-triazolecarboxamide IUPAC Name: 1-[4-[(2-hydroxy-5-methoxyphenyl)methylamino]cyclohexyl]-N-(2-methylpropyl)triazole-4-carboxamide Traditional Name: 1-[4-[(2-hydroxy-5-methoxy-benzyl)amino]cyclohexyl]-N-isobutyl-triazole-4-carboxamide Formula: C21H31N5O3 MolecularWeight: 401.50254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(N=N1)C2CCC(CC2)NCC3=C(C=CC(=C3)OC)O

Isomeric SMILES

CC(C)CNC(=O)C1=CN(N=N1)C2CCC(CC2)NCC3=C(C=CC(=C3)OC)O

InChI

InChI=1S/C21H31N5O3/c1-14(2)11-23-21(28)19-13-26(25-24-19)17-6-4-16(5-7-17)22-12-15-10-18(29-3)8-9-20(15)27/h8-10,13-14,16-17,22,27H,4-7,11-12H2,1-3H3,(H,23,28)