5-(2-chloranyl-4-nitro-phenyl)sulfanyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)sulfanyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-(2-chloro-4-nitro-phenyl)sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2-chloro-4-nitrophenyl)thio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(2-chloro-4-nitrophenyl)sulfanyl-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[(2-chloro-4-nitro-phenyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C11H9ClN4O2S2 MolecularWeight: 328.79776

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)SC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C=CCNC1=NN=C(S1)SC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H9ClN4O2S2/c1-2-5-13-10-14-15-11(20-10)19-9-4-3-7(16(17)18)6-8(9)12/h2-4,6H,1,5H2,(H,13,14)