N-(4-methylphenyl)-1,1,4,4-tetrakis(oxidanylidene)-6-phenyl-2,3-dihydro-1,4-dithiine-5-carboxamide

Systemtic Name: N-(4-methylphenyl)-1,1,4,4-tetrakis(oxidanylidene)-6-phenyl-2,3-dihydro-1,4-dithiine-5-carboxamide Openeye Name: 1,1,4,4-tetraoxo-6-phenyl-N-(p-tolyl)-2,3-dihydro-1,4-dithiine-5-carboxamide CAS Name: N-(4-methylphenyl)-1,1,4,4-tetraoxo-6-phenyl-2,3-dihydro-1,4-dithiin-5-carboxamide IUPAC Name: N-(4-methylphenyl)-1,1,4,4-tetraoxo-6-phenyl-2,3-dihydro-1,4-dithiine-5-carboxamide Traditional Name: 1,1,4,4-tetraketo-6-phenyl-N-(p-tolyl)-2,3-dihydro-1,4-dithiin-5-carboxamide Formula: C18H17NO5S2 MolecularWeight: 391.46128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(S(=O)(=O)CCS2(=O)=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(S(=O)(=O)CCS2(=O)=O)C3=CC=CC=C3

InChI

InChI=1S/C18H17NO5S2/c1-13-7-9-15(10-8-13)19-18(20)17-16(14-5-3-2-4-6-14)25(21,22)11-12-26(17,23)24/h2-10H,11-12H2,1H3,(H,19,20)