prop-2-enyl N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]carbamate

Systemtic Name: prop-2-enyl N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: allyl N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]carbamate CAS Name: N-[5-[(4-chlorophenyl)methylthio]-1,3,4-thiadiazol-2-yl]carbamic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N-[5-[(4-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]carbamate Traditional Name: N-[5-[(4-chlorobenzyl)thio]-1,3,4-thiadiazol-2-yl]carbamic acid allyl ester Formula: C13H12ClN3O2S2 MolecularWeight: 341.83628

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)Cl

Isomeric SMILES

C=CCOC(=O)NC1=NN=C(S1)SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H12ClN3O2S2/c1-2-7-19-12(18)15-11-16-17-13(21-11)20-8-9-3-5-10(14)6-4-9/h2-6H,1,7-8H2,(H,15,16,18)