6-[1-(1H-imidazol-5-yl)-2-methyl-1-oxidanyl-propyl]-1-propyl-naphthalene-2-carboxamide

Systemtic Name: 6-[1-(1H-imidazol-5-yl)-2-methyl-1-oxidanyl-propyl]-1-propyl-naphthalene-2-carboxamide Openeye Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methyl-propyl]-1-propyl-naphthalene-2-carboxamide CAS Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-1-propyl-2-naphthalenecarboxamide IUPAC Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-1-propylnaphthalene-2-carboxamide Traditional Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methyl-propyl]-1-propyl-2-naphthamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1C=CC(=C2)C(C3=CN=CN3)(C(C)C)O)C(=O)N

Isomeric SMILES

CCCC1=C(C=CC2=C1C=CC(=C2)C(C3=CN=CN3)(C(C)C)O)C(=O)N

InChI

InChI=1S/C21H25N3O2/c1-4-5-17-16-9-7-15(10-14(16)6-8-18(17)20(22)25)21(26,13(2)3)19-11-23-12-24-19/h6-13,26H,4-5H2,1-3H3,(H2,22,25)(H,23,24)