N-(1,3-benzodioxol-5-ylmethyl)-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propan-1-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-methyltetrazol-5-yl)sulfanyl-propan-1-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1-methyl-5-tetrazolyl)thio]-1-propanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1-methyltetrazol-5-yl)sulfanylpropan-1-amine Traditional Name: 3-[(1-methyltetrazol-5-yl)thio]propyl-piperonyl-amine Formula: C13H17N5O2S MolecularWeight: 307.37138

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCCNCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=NN=N1)SCCCNCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H17N5O2S/c1-18-13(15-16-17-18)21-6-2-5-14-8-10-3-4-11-12(7-10)20-9-19-11/h3-4,7,14H,2,5-6,8-9H2,1H3