5-[(4-heptoxy-3-methoxy-phenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Systemtic Name: 5-[(4-heptoxy-3-methoxy-phenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one Openeye Name: 5-[(4-heptoxy-3-methoxy-phenyl)methylene]thiazolo[3,2-b][1,2,4]triazol-6-one CAS Name: 5-[(4-heptoxy-3-methoxyphenyl)methylidene]-6-thiazolo[3,2-b][1,2,4]triazolone IUPAC Name: 5-[(4-heptoxy-3-methoxyphenyl)methylidene]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one Traditional Name: 5-(4-heptoxy-3-methoxy-benzylidene)thiazolo[3,2-b][1,2,4]triazol-6-one Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC=N3)S2)OC

Isomeric SMILES

CCCCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC=N3)S2)OC

InChI

InChI=1S/C19H23N3O3S/c1-3-4-5-6-7-10-25-15-9-8-14(11-16(15)24-2)12-17-18(23)22-19(26-17)20-13-21-22/h8-9,11-13H,3-7,10H2,1-2H3