N-[4-(2-methylbutan-2-yl)cyclohexyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[4-(1,1-dimethylpropyl)cyclohexyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(4-tert-amylcyclohexyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C25H29NO4S MolecularWeight: 439.56706

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C25H29NO4S/c1-4-25(2,3)17-10-12-18(13-11-17)26-24(28)16-9-14-20-22(15-16)31(29,30)21-8-6-5-7-19(21)23(20)27/h5-9,14-15,17-18H,4,10-13H2,1-3H3,(H,26,28)