1-[3-[(4-chlorophenyl)methylsulfanyl]-4-cyano-1,2-thiazol-5-yl]-3-methyl-urea

Systemtic Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-4-cyano-1,2-thiazol-5-yl]-3-methyl-urea Openeye Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-4-cyano-isothiazol-5-yl]-3-methyl-urea CAS Name: 1-[3-[(4-chlorophenyl)methylthio]-4-cyano-5-isothiazolyl]-3-methylurea IUPAC Name: 1-[3-[(4-chlorophenyl)methylsulfanyl]-4-cyano-1,2-thiazol-5-yl]-3-methylurea Traditional Name: 1-[3-[(4-chlorobenzyl)thio]-4-cyano-isothiazol-5-yl]-3-methyl-urea Formula: C13H11ClN4OS2 MolecularWeight: 338.83564

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=C(C(=NS1)SCC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CNC(=O)NC1=C(C(=NS1)SCC2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C13H11ClN4OS2/c1-16-13(19)17-11-10(6-15)12(18-21-11)20-7-8-2-4-9(14)5-3-8/h2-5H,7H2,1H3,(H2,16,17,19)