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

Systemtic Name: butyl N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamate Openeye Name: butyl N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamate CAS Name: N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester IUPAC Name: butyl N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamate Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester Formula: C14H17N3O2S2 MolecularWeight: 323.43368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2

InChI

InChI=1S/C14H17N3O2S2/c1-2-3-9-19-13(18)15-12-16-17-14(21-12)20-10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,15,16,18)