3-chloranyl-1-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2,2-dimethyl-propan-1-one

Systemtic Name: 3-chloranyl-1-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2,2-dimethyl-propan-1-one Openeye Name: 3-chloro-1-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one CAS Name: 3-chloro-1-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2,2-dimethyl-1-propanone IUPAC Name: 3-chloro-1-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)-2,2-dimethylpropan-1-one Traditional Name: 3-chloro-1-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]-2,2-dimethyl-propan-1-one Formula: C12H14ClN3O2S MolecularWeight: 299.77646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(=O)N1C(=NC(=N1)OC)C2=CC=CS2

Isomeric SMILES

CC(C)(CCl)C(=O)N1C(=NC(=N1)OC)C2=CC=CS2

InChI

InChI=1S/C12H14ClN3O2S/c1-12(2,7-13)10(17)16-9(8-5-4-6-19-8)14-11(15-16)18-3/h4-6H,7H2,1-3H3