N-(4-octylphenyl)-4-oxidanylidene-2,3-dihydrothiochromene-3-carboxamide

Systemtic Name: N-(4-octylphenyl)-4-oxidanylidene-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-(4-octylphenyl)-4-oxo-thiochromane-3-carboxamide CAS Name: N-(4-octylphenyl)-4-oxo-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-(4-octylphenyl)-4-oxo-2,3-dihydrothiochromene-3-carboxamide Traditional Name: 4-keto-N-(4-octylphenyl)thiochroman-3-carboxamide Formula: C24H29NO2S MolecularWeight: 395.55756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)NC(=O)C2CSC3=CC=CC=C3C2=O

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)NC(=O)C2CSC3=CC=CC=C3C2=O

InChI

InChI=1S/C24H29NO2S/c1-2-3-4-5-6-7-10-18-13-15-19(16-14-18)25-24(27)21-17-28-22-12-9-8-11-20(22)23(21)26/h8-9,11-16,21H,2-7,10,17H2,1H3,(H,25,27)