4-[(4-fluorophenyl)methyl]-3-(3-morpholin-4-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(4-fluorophenyl)methyl]-3-(3-morpholin-4-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(4-fluorophenyl)methyl]-3-(3-morpholinosulfonylphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(4-fluorophenyl)methyl]-3-[3-(4-morpholinylsulfonyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(4-fluorophenyl)methyl]-3-(3-morpholin-4-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(4-fluorobenzyl)-3-(3-morpholinosulfonylphenyl)-1H-1,2,4-triazole-5-thione Formula: C19H19FN4O3S2 MolecularWeight: 434.507563

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C3=NNC(=S)N3CC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)C3=NNC(=S)N3CC4=CC=C(C=C4)F

InChI

InChI=1S/C19H19FN4O3S2/c20-16-6-4-14(5-7-16)13-24-18(21-22-19(24)28)15-2-1-3-17(12-15)29(25,26)23-8-10-27-11-9-23/h1-7,12H,8-11,13H2,(H,22,28)