N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(2,5-dimethylphenoxy)ethylthio]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(2,5-dimethylphenoxy)ethylsulfanyl]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(2,5-dimethylphenoxy)ethylthio]propionamide Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCSCCC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCSCCC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H25NO4S/c1-15-3-4-16(2)19(13-15)26-10-12-27-11-7-21(23)22-17-5-6-18-20(14-17)25-9-8-24-18/h3-6,13-14H,7-12H2,1-2H3,(H,22,23)