N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl]ethanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl]ethanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-chlorothiadiazol-4-yl)methyl]ethanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-chloro-4-thiadiazolyl)methyl]ethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(5-chlorothiadiazol-4-yl)methyl]ethanamine Traditional Name: (5-chlorothiadiazol-4-yl)methyl-ethyl-piperonyl-amine Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)CC3=C(SN=N3)Cl

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)CC3=C(SN=N3)Cl

InChI

InChI=1S/C13H14ClN3O2S/c1-2-17(7-10-13(14)20-16-15-10)6-9-3-4-11-12(5-9)19-8-18-11/h3-5H,2,6-8H2,1H3