4-[(E)-(4-hexoxy-3-methoxy-phenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(4-hexoxy-3-methoxy-phenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(4-hexoxy-3-methoxy-phenyl)methyleneamino]-3-isopropyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(4-hexoxy-3-methoxyphenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(4-hexoxy-3-methoxyphenyl)methylideneamino]-3-propan-2-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(4-hexoxy-3-methoxy-benzylidene)amino]-3-isopropyl-1H-1,2,4-triazole-5-thione Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C(C)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=N/N2C(=NNC2=S)C(C)C)OC

InChI

InChI=1S/C19H28N4O2S/c1-5-6-7-8-11-25-16-10-9-15(12-17(16)24-4)13-20-23-18(14(2)3)21-22-19(23)26/h9-10,12-14H,5-8,11H2,1-4H3,(H,22,26)/b20-13+