(E)-1-(dimethylamino)-4-(1,2,4-triazol-1-yl)pent-1-en-3-one

Systemtic Name: (E)-1-(dimethylamino)-4-(1,2,4-triazol-1-yl)pent-1-en-3-one Openeye Name: (E)-1-(dimethylamino)-4-(1,2,4-triazol-1-yl)pent-1-en-3-one CAS Name: (E)-1-(dimethylamino)-4-(1,2,4-triazol-1-yl)-1-penten-3-one IUPAC Name: (E)-1-(dimethylamino)-4-(1,2,4-triazol-1-yl)pent-1-en-3-one Traditional Name: (E)-1-(dimethylamino)-4-(1,2,4-triazol-1-yl)pent-1-en-3-one Formula: C9H14N4O MolecularWeight: 194.23366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C=CN(C)C)N1C=NC=N1

Isomeric SMILES

CC(C(=O)/C=C/N(C)C)N1C=NC=N1

InChI

InChI=1S/C9H14N4O/c1-8(13-7-10-6-11-13)9(14)4-5-12(2)3/h4-8H,1-3H3/b5-4+