N-(3-chloranyl-2,6-diethyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetamide Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H22ClNO3S/c1-3-13-5-7-16(21)15(4-2)20(13)22-19(23)12-26-14-6-8-17-18(11-14)25-10-9-24-17/h5-8,11H,3-4,9-10,12H2,1-2H3,(H,22,23)