N-[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]cyclopentanecarboxamide

Systemtic Name: N-[2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]cyclopentanecarboxamide Openeye Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]cyclopentanecarboxamide CAS Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]phenyl]cyclopentanecarboxamide IUPAC Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phenyl]cyclopentanecarboxamide Traditional Name: N-[2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]phenyl]cyclopentanecarboxamide Formula: C21H22ClNO3S MolecularWeight: 403.92228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=CC=CC=C2SCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

C1CCC(C1)C(=O)NC2=CC=CC=C2SCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C21H22ClNO3S/c22-17-9-15-11-25-13-26-20(15)16(10-17)12-27-19-8-4-3-7-18(19)23-21(24)14-5-1-2-6-14/h3-4,7-10,14H,1-2,5-6,11-13H2,(H,23,24)