4-(3-ethoxypropyl)-3-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-ethoxypropyl)-3-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-ethoxypropyl)-3-[3-[(4-isopropylphenoxy)methyl]phenyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-ethoxypropyl)-3-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-ethoxypropyl)-3-[3-[(4-propan-2-ylphenoxy)methyl]phenyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-ethoxypropyl)-3-[3-[(4-isopropylphenoxy)methyl]phenyl]-1H-1,2,4-triazole-5-thione Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=NNC1=S)C2=CC(=CC=C2)COC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOCCCN1C(=NNC1=S)C2=CC(=CC=C2)COC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C23H29N3O2S/c1-4-27-14-6-13-26-22(24-25-23(26)29)20-8-5-7-18(15-20)16-28-21-11-9-19(10-12-21)17(2)3/h5,7-12,15,17H,4,6,13-14,16H2,1-3H3,(H,25,29)