N-[2-(4-chlorophenyl)sulfanylethyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C22H16ClNO4S2 MolecularWeight: 457.94974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NCCSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NCCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClNO4S2/c23-15-6-8-16(9-7-15)29-12-11-24-22(26)14-5-10-18-20(13-14)30(27,28)19-4-2-1-3-17(19)21(18)25/h1-10,13H,11-12H2,(H,24,26)