3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-ethyl-4-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=CC3=C(C(=C2)OC)OCO3

Isomeric SMILES

CCC1=NNC(=S)N1/N=C\C2=CC3=C(C(=C2)OC)OCO3

InChI

InChI=1S/C13H14N4O3S/c1-3-11-15-16-13(21)17(11)14-6-8-4-9(18-2)12-10(5-8)19-7-20-12/h4-6H,3,7H2,1-2H3,(H,16,21)/b14-6-