2-chloranyl-N-[5-(2-methyl-3-oxidanylidene-1,2,4-triazolidin-1-yl)-2-phenyl-4-propyl-phenyl]sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[5-(2-methyl-3-oxidanylidene-1,2,4-triazolidin-1-yl)-2-phenyl-4-propyl-phenyl]sulfonyl-benzamide Openeye Name: 2-chloro-N-[5-(2-methyl-3-oxo-1,2,4-triazolidin-1-yl)-2-phenyl-4-propyl-phenyl]sulfonyl-benzamide CAS Name: 2-chloro-N-[5-(2-methyl-3-oxo-1,2,4-triazolidin-1-yl)-2-phenyl-4-propylphenyl]sulfonylbenzamide IUPAC Name: 2-chloro-N-[5-(2-methyl-3-oxo-1,2,4-triazolidin-1-yl)-2-phenyl-4-propylphenyl]sulfonylbenzamide Traditional Name: 2-chloro-N-[5-(3-keto-2-methyl-1,2,4-triazolidin-1-yl)-2-phenyl-4-propyl-phenyl]sulfonyl-benzamide Formula: C25H25ClN4O4S MolecularWeight: 513.0084

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C(=C1)C2=CC=CC=C2)S(=O)(=O)NC(=O)C3=CC=CC=C3Cl)N4CNC(=O)N4C

Isomeric SMILES

CCCC1=C(C=C(C(=C1)C2=CC=CC=C2)S(=O)(=O)NC(=O)C3=CC=CC=C3Cl)N4CNC(=O)N4C

InChI

InChI=1S/C25H25ClN4O4S/c1-3-9-18-14-20(17-10-5-4-6-11-17)23(15-22(18)30-16-27-25(32)29(30)2)35(33,34)28-24(31)19-12-7-8-13-21(19)26/h4-8,10-15H,3,9,16H2,1-2H3,(H,27,32)(H,28,31)