2-ethyl-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one

Systemtic Name: 2-ethyl-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one Openeye Name: 4-allyl-2-ethyl-5-(2-thienyl)-1,2,4-triazol-3-one CAS Name: 2-ethyl-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one IUPAC Name: 2-ethyl-4-prop-2-enyl-5-thiophen-2-yl-1,2,4-triazol-3-one Traditional Name: 4-allyl-2-ethyl-5-(2-thienyl)-1,2,4-triazol-3-one Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)N(C(=N1)C2=CC=CS2)CC=C

Isomeric SMILES

CCN1C(=O)N(C(=N1)C2=CC=CS2)CC=C

InChI

InChI=1S/C11H13N3OS/c1-3-7-13-10(9-6-5-8-16-9)12-14(4-2)11(13)15/h3,5-6,8H,1,4,7H2,2H3