4-(3-methoxypropyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-methoxypropyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-methoxypropyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-methoxypropyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-methoxypropyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-methoxypropyl)-3-(3,4,5-triethoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C18H27N3O4S MolecularWeight: 381.48968

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C2=NNC(=S)N2CCCOC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C2=NNC(=S)N2CCCOC

InChI

InChI=1S/C18H27N3O4S/c1-5-23-14-11-13(12-15(24-6-2)16(14)25-7-3)17-19-20-18(26)21(17)9-8-10-22-4/h11-12H,5-10H2,1-4H3,(H,20,26)