7-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine

Systemtic Name: 7-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Openeye Name: 7-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine CAS Name: 7-[[(1-cyclopropyl-5-tetrazolyl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-amine IUPAC Name: 7-[(1-cyclopropyltetrazol-5-yl)sulfanylmethyl]-2,3-dihydro-1,4-benzodioxin-6-amine Traditional Name: [7-[[(1-cyclopropyltetrazol-5-yl)thio]methyl]-2,3-dihydro-1,4-benzodioxin-6-yl]amine Formula: C13H15N5O2S MolecularWeight: 305.3555

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCC3=CC4=C(C=C3N)OCCO4

Isomeric SMILES

C1CC1N2C(=NN=N2)SCC3=CC4=C(C=C3N)OCCO4

InChI

InChI=1S/C13H15N5O2S/c14-10-6-12-11(19-3-4-20-12)5-8(10)7-21-13-15-16-17-18(13)9-1-2-9/h5-6,9H,1-4,7,14H2