[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-(4-butylphenyl)methanone

Systemtic Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-(4-butylphenyl)methanone Openeye Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-(4-butylphenyl)methanone CAS Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-(4-butylphenyl)methanone IUPAC Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-(4-butylphenyl)methanone Traditional Name: [3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]-(4-butylphenyl)methanone Formula: C25H31N3O2 MolecularWeight: 405.53254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)OCCCC)C3=CC=C(C=C3)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2C(=NC(=N2)OCCCC)C3=CC=C(C=C3)CC

InChI

InChI=1S/C25H31N3O2/c1-4-7-9-20-12-16-22(17-13-20)24(29)28-23(21-14-10-19(6-3)11-15-21)26-25(27-28)30-18-8-5-2/h10-17H,4-9,18H2,1-3H3