1-(4-chlorophenyl)-3-(dimethylamino)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one

Systemtic Name: 1-(4-chlorophenyl)-3-(dimethylamino)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one Openeye Name: 1-(4-chlorophenyl)-3-(dimethylamino)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one CAS Name: 1-(4-chlorophenyl)-3-(dimethylamino)-2-(1,2,4-triazol-1-yl)-2-propen-1-one IUPAC Name: 1-(4-chlorophenyl)-3-(dimethylamino)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one Traditional Name: 1-(4-chlorophenyl)-3-(dimethylamino)-2-(1,2,4-triazol-1-yl)prop-2-en-1-one Formula: C13H13ClN4O MolecularWeight: 276.72152

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C(=O)C1=CC=C(C=C1)Cl)N2C=NC=N2

Isomeric SMILES

CN(C)C=C(C(=O)C1=CC=C(C=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C13H13ClN4O/c1-17(2)7-12(18-9-15-8-16-18)13(19)10-3-5-11(14)6-4-10/h3-9H,1-2H3