N-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]-4-oxidanylidene-2,3-dihydrothiochromene-3-carboxamide

Systemtic Name: N-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]-4-oxidanylidene-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]-4-oxo-thiochromane-3-carboxamide CAS Name: N-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]-4-oxo-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]-4-oxo-2,3-dihydrothiochromene-3-carboxamide Traditional Name: N-[4-[2-(3,4-dimethylphenyl)ethyl]phenyl]-4-keto-thiochroman-3-carboxamide Formula: C26H25NO2S MolecularWeight: 415.5472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC2=CC=C(C=C2)NC(=O)C3CSC4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)CCC2=CC=C(C=C2)NC(=O)C3CSC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C26H25NO2S/c1-17-7-8-20(15-18(17)2)10-9-19-11-13-21(14-12-19)27-26(29)23-16-30-24-6-4-3-5-22(24)25(23)28/h3-8,11-15,23H,9-10,16H2,1-2H3,(H,27,29)