1-(1,4-diazepan-1-yl)-3-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-(1,4-diazepan-1-yl)-3-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-(1,4-diazepan-1-yl)-3-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-(1,4-diazepan-1-yl)-3-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-(1,4-diazepan-1-yl)-3-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-(1,4-diazepan-1-yl)-3-(1,2,4-triazol-1-yl)propan-1-one Formula: C10H17N5O MolecularWeight: 223.27488

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)CCN2C=NC=N2

Isomeric SMILES

C1CNCCN(C1)C(=O)CCN2C=NC=N2

InChI

InChI=1S/C10H17N5O/c16-10(2-6-15-9-12-8-13-15)14-5-1-3-11-4-7-14/h8-9,11H,1-7H2