9,10,10-tris(oxidanylidene)-N-prop-2-enyl-N-(thiophen-2-ylmethyl)thioxanthene-3-carboxamide

Systemtic Name: 9,10,10-tris(oxidanylidene)-N-prop-2-enyl-N-(thiophen-2-ylmethyl)thioxanthene-3-carboxamide Openeye Name: N-allyl-9,10,10-trioxo-N-(2-thienylmethyl)thioxanthene-3-carboxamide CAS Name: 9,10,10-trioxo-N-prop-2-enyl-N-(thiophen-2-ylmethyl)-3-thioxanthenecarboxamide IUPAC Name: 9,10,10-trioxo-N-prop-2-enyl-N-(thiophen-2-ylmethyl)thioxanthene-3-carboxamide Traditional Name: N-allyl-9,10,10-triketo-N-(2-thenyl)thioxanthene-3-carboxamide Formula: C22H17NO4S2 MolecularWeight: 423.50468

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CS1)C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C=CCN(CC1=CC=CS1)C(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C22H17NO4S2/c1-2-11-23(14-16-6-5-12-28-16)22(25)15-9-10-18-20(13-15)29(26,27)19-8-4-3-7-17(19)21(18)24/h2-10,12-13H,1,11,14H2