5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-cyclopentyl-1,2,3,4-tetrazole

Systemtic Name: 5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-cyclopentyl-1,2,3,4-tetrazole Openeye Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-cyclopentyl-tetrazole CAS Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1-cyclopentyltetrazole IUPAC Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1-cyclopentyltetrazole Traditional Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1-cyclopentyl-tetrazole Formula: C15H17ClN4O2S MolecularWeight: 352.83908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SCC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C15H17ClN4O2S/c16-12-7-10(8-13-14(12)22-6-5-21-13)9-23-15-17-18-19-20(15)11-3-1-2-4-11/h7-8,11H,1-6,9H2