2-chloranyl-N-(4-methylphenyl)-5-[(3-oxidanylidene-1,2,4-triazinan-4-yl)sulfonyl]-4-sulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-(4-methylphenyl)-5-[(3-oxidanylidene-1,2,4-triazinan-4-yl)sulfonyl]-4-sulfanyl-benzamide Openeye Name: 2-chloro-5-[(3-oxo-1,2,4-triazinan-4-yl)sulfonyl]-N-(p-tolyl)-4-sulfanyl-benzamide CAS Name: 2-chloro-4-mercapto-N-(4-methylphenyl)-5-[(3-oxo-1,2,4-triazinan-4-yl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-(4-methylphenyl)-5-[(3-oxo-1,2,4-triazinan-4-yl)sulfonyl]-4-sulfanylbenzamide Traditional Name: 2-chloro-5-[(3-keto-1,2,4-triazinan-4-yl)sulfonyl]-4-mercapto-N-(p-tolyl)benzamide Formula: C17H17ClN4O4S2 MolecularWeight: 440.92428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)S)S(=O)(=O)N3CCNNC3=O

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)S)S(=O)(=O)N3CCNNC3=O

InChI

InChI=1S/C17H17ClN4O4S2/c1-10-2-4-11(5-3-10)20-16(23)12-8-15(14(27)9-13(12)18)28(25,26)22-7-6-19-21-17(22)24/h2-5,8-9,19,27H,6-7H2,1H3,(H,20,23)(H,21,24)