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

Systemtic Name: N-[2-(4-butoxyphenyl)ethyl]-4-oxidanylidene-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Openeye Name: N-[2-(4-butoxyphenyl)ethyl]-4-oxo-N-phenyl-thiochromane-3-carboxamide CAS Name: N-[2-(4-butoxyphenyl)ethyl]-4-oxo-N-phenyl-2,3-dihydro-1-benzothiopyran-3-carboxamide IUPAC Name: N-[2-(4-butoxyphenyl)ethyl]-4-oxo-N-phenyl-2,3-dihydrothiochromene-3-carboxamide Traditional Name: N-[2-(4-butoxyphenyl)ethyl]-4-keto-N-phenyl-thiochroman-3-carboxamide Formula: C28H29NO3S MolecularWeight: 459.59976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CCN(C2=CC=CC=C2)C(=O)C3CSC4=CC=CC=C4C3=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CCN(C2=CC=CC=C2)C(=O)C3CSC4=CC=CC=C4C3=O

InChI

InChI=1S/C28H29NO3S/c1-2-3-19-32-23-15-13-21(14-16-23)17-18-29(22-9-5-4-6-10-22)28(31)25-20-33-26-12-8-7-11-24(26)27(25)30/h4-16,25H,2-3,17-20H2,1H3