5-[[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[[(4-morpholin-4-ylsulfonylphenyl)carbonylamino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate Openeye Name: 5-[[(4-morpholinosulfonylbenzoyl)amino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate CAS Name: 5-[[[[4-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-[[(4-morpholin-4-ylsulfonylbenzoyl)amino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[[(4-morpholinosulfonylbenzoyl)amino]methyl]-4-phenyl-1,2,4-triazole-3-thiolate Formula: C20H20N5O4S2- MolecularWeight: 458.5339

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NN=C(N3C4=CC=CC=C4)[S-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=NN=C(N3C4=CC=CC=C4)[S-]

InChI

InChI=1S/C20H21N5O4S2/c26-19(21-14-18-22-23-20(30)25(18)16-4-2-1-3-5-16)15-6-8-17(9-7-15)31(27,28)24-10-12-29-13-11-24/h1-9H,10-14H2,(H,21,26)(H,23,30)/p-1