1-imidazol-1-yl-4-(1,2,4-triazol-1-yl)butan-1-one

Systemtic Name: 1-imidazol-1-yl-4-(1,2,4-triazol-1-yl)butan-1-one Openeye Name: 1-imidazol-1-yl-4-(1,2,4-triazol-1-yl)butan-1-one CAS Name: 1-(1-imidazolyl)-4-(1,2,4-triazol-1-yl)-1-butanone IUPAC Name: 1-imidazol-1-yl-4-(1,2,4-triazol-1-yl)butan-1-one Traditional Name: 1-imidazol-1-yl-4-(1,2,4-triazol-1-yl)butan-1-one Formula: C9H11N5O MolecularWeight: 205.21654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C(=O)CCCN2C=NC=N2

Isomeric SMILES

C1=CN(C=N1)C(=O)CCCN2C=NC=N2

InChI

InChI=1S/C9H11N5O/c15-9(13-5-3-10-7-13)2-1-4-14-8-11-6-12-14/h3,5-8H,1-2,4H2