5-(1,3-benzodioxol-5-yl)-N-propyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-propyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-propyl-1,3,4-thiadiazol-2-amine CAS Name: 5-(1,3-benzodioxol-5-yl)-N-propyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-propyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-propyl-amine Formula: C12H13N3O2S MolecularWeight: 263.31552

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCNC1=NN=C(S1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H13N3O2S/c1-2-5-13-12-15-14-11(18-12)8-3-4-9-10(6-8)17-7-16-9/h3-4,6H,2,5,7H2,1H3,(H,13,15)