2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: 2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(p-tolylsulfonyl)acetamide CAS Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(4-methylphenyl)sulfonylacetamide IUPAC Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)sulfonylacetamide Traditional Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-tosyl-acetamide Formula: C14H19N5O3S2 MolecularWeight: 369.46236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N)SCC(=O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCC1=NN=C(N1N)SCC(=O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C14H19N5O3S2/c1-3-4-12-16-17-14(19(12)15)23-9-13(20)18-24(21,22)11-7-5-10(2)6-8-11/h5-8H,3-4,9,15H2,1-2H3,(H,18,20)