2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,3,4-oxadiazole

Systemtic Name: 2-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,3,4-oxadiazole Openeye Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-5-(2-thienyl)-1,3,4-oxadiazole CAS Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylthio]-5-thiophen-2-yl-1,3,4-oxadiazole IUPAC Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-5-thiophen-2-yl-1,3,4-oxadiazole Traditional Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylthio]-5-(2-thienyl)-1,3,4-oxadiazole Formula: C16H13ClN2O3S2 MolecularWeight: 380.86902

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CSC3=NN=C(O3)C4=CC=CS4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CSC3=NN=C(O3)C4=CC=CS4)Cl)OC1

InChI

InChI=1S/C16H13ClN2O3S2/c17-11-7-10(8-12-14(11)21-5-2-4-20-12)9-24-16-19-18-15(22-16)13-3-1-6-23-13/h1,3,6-8H,2,4-5,9H2