2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-prop-2-enyl-benzimidazole

Systemtic Name: 2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-prop-2-enyl-benzimidazole Openeye Name: 1-allyl-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]benzimidazole CAS Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1-prop-2-enylbenzimidazole IUPAC Name: 2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1-prop-2-enylbenzimidazole Traditional Name: 1-allyl-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]benzimidazole Formula: C19H17ClN2O2S MolecularWeight: 372.86848

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N=C1SCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

C=CCN1C2=CC=CC=C2N=C1SCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C19H17ClN2O2S/c1-2-7-22-17-6-4-3-5-16(17)21-19(22)25-11-14-9-15(20)8-13-10-23-12-24-18(13)14/h2-6,8-9H,1,7,10-12H2