5-(1,2-oxazol-5-ylmethylsulfanyl)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(1,2-oxazol-5-ylmethylsulfanyl)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-(isoxazol-5-ylmethylsulfanyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(5-isoxazolylmethylthio)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1,2-oxazol-5-ylmethylsulfanyl)-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-(isoxazol-5-ylmethylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C9H10N4OS2 MolecularWeight: 254.3319

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)SCC2=CC=NO2

Isomeric SMILES

C=CCNC1=NN=C(S1)SCC2=CC=NO2

InChI

InChI=1S/C9H10N4OS2/c1-2-4-10-8-12-13-9(16-8)15-6-7-3-5-11-14-7/h2-3,5H,1,4,6H2,(H,10,12)