4-butan-2-yl-3-(3-morpholin-4-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-butan-2-yl-3-(3-morpholin-4-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(3-morpholinosulfonylphenyl)-4-sec-butyl-1H-1,2,4-triazole-5-thione CAS Name: 4-butan-2-yl-3-[3-(4-morpholinylsulfonyl)phenyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-butan-2-yl-3-(3-morpholin-4-ylsulfonylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(3-morpholinosulfonylphenyl)-4-sec-butyl-1H-1,2,4-triazole-5-thione Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NNC1=S)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC(C)N1C(=NNC1=S)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C16H22N4O3S2/c1-3-12(2)20-15(17-18-16(20)24)13-5-4-6-14(11-13)25(21,22)19-7-9-23-10-8-19/h4-6,11-12H,3,7-10H2,1-2H3,(H,18,24)