9,10,10-tris(oxidanylidene)-N-(phenylmethyl)thioxanthene-3-carboxamide

Systemtic Name: 9,10,10-tris(oxidanylidene)-N-(phenylmethyl)thioxanthene-3-carboxamide Openeye Name: N-benzyl-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: 9,10,10-trioxo-N-(phenylmethyl)-3-thioxanthenecarboxamide IUPAC Name: N-benzyl-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-benzyl-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C21H15NO4S MolecularWeight: 377.4131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C21H15NO4S/c23-20-16-8-4-5-9-18(16)27(25,26)19-12-15(10-11-17(19)20)21(24)22-13-14-6-2-1-3-7-14/h1-12H,13H2,(H,22,24)