2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(3-cyanophenyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(3-cyanophenyl)ethanamide Openeye Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(3-cyanophenyl)acetamide CAS Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(3-cyanophenyl)acetamide IUPAC Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-(3-cyanophenyl)acetamide Traditional Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-(3-cyanophenyl)acetamide Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)CSCC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)CSCC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H15ClN2O3S/c19-15-7-13(8-16-18(15)24-5-4-23-16)10-25-11-17(22)21-14-3-1-2-12(6-14)9-20/h1-3,6-8H,4-5,10-11H2,(H,21,22)