N-[2-[(2S)-butan-2-yl]phenyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[2-[(2S)-butan-2-yl]phenyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[2-[(1S)-1-methylpropyl]phenyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[2-[(2S)-butan-2-yl]phenyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[2-[(2S)-butan-2-yl]phenyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: 9,10,10-triketo-N-[2-[(1S)-1-methylpropyl]phenyl]thioxanthene-3-carboxamide Formula: C24H21NO4S MolecularWeight: 419.49284

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C24H21NO4S/c1-3-15(2)17-8-4-6-10-20(17)25-24(27)16-12-13-19-22(14-16)30(28,29)21-11-7-5-9-18(21)23(19)26/h4-15H,3H2,1-2H3,(H,25,27)/t15-/m0/s1