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

Systemtic Name: 1-cyclopentyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-cyclopentyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]tetrazole CAS Name: 1-cyclopentyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]tetrazole IUPAC Name: 1-cyclopentyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylsulfanyl]tetrazole Traditional Name: 1-cyclopentyl-5-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylthio]tetrazole Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCC3COC4=CC=CC=C4O3

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SC[C@@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C15H18N4O2S/c1-2-6-11(5-1)19-15(16-17-18-19)22-10-12-9-20-13-7-3-4-8-14(13)21-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2/t12-/m0/s1