butyl N-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]carbamate

Systemtic Name: butyl N-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: butyl N-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]carbamate CAS Name: N-[5-[[(4-chlorophenyl)methylthio]methyl]-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester IUPAC Name: butyl N-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]carbamate Traditional Name: N-[5-[[(4-chlorobenzyl)thio]methyl]-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester Formula: C15H18ClN3O2S2 MolecularWeight: 371.90532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=NN=C(S1)CSCC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCOC(=O)NC1=NN=C(S1)CSCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H18ClN3O2S2/c1-2-3-8-21-15(20)17-14-19-18-13(23-14)10-22-9-11-4-6-12(16)7-5-11/h4-7H,2-3,8-10H2,1H3,(H,17,19,20)