4-cyclopentyl-3-(phenylmethyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-cyclopentyl-3-(phenylmethyl)-1H-1,2,4-triazol-5-one Openeye Name: 3-benzyl-4-cyclopentyl-1H-1,2,4-triazol-5-one CAS Name: 4-cyclopentyl-3-(phenylmethyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-benzyl-4-cyclopentyl-1H-1,2,4-triazol-5-one Traditional Name: 3-benzyl-4-cyclopentyl-1H-1,2,4-triazol-5-one Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NNC2=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)N2C(=NNC2=O)CC3=CC=CC=C3

InChI

InChI=1S/C14H17N3O/c18-14-16-15-13(10-11-6-2-1-3-7-11)17(14)12-8-4-5-9-12/h1-3,6-7,12H,4-5,8-10H2,(H,16,18)