4-(2-chlorophenyl)sulfanyl-N-cyano-N-methyl-butanamide

Systemtic Name: 4-(2-chlorophenyl)sulfanyl-N-cyano-N-methyl-butanamide Openeye Name: 4-(2-chlorophenyl)sulfanyl-N-cyano-N-methyl-butanamide CAS Name: 4-[(2-chlorophenyl)thio]-N-cyano-N-methylbutanamide IUPAC Name: 4-(2-chlorophenyl)sulfanyl-N-cyano-N-methylbutanamide Traditional Name: 4-[(2-chlorophenyl)thio]-N-cyano-N-methyl-butyramide Formula: C12H13ClN2OS MolecularWeight: 268.76242

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Descriptors Computed from Structure

Canonical SMILES:

CN(C#N)C(=O)CCCSC1=CC=CC=C1Cl

Isomeric SMILES

CN(C#N)C(=O)CCCSC1=CC=CC=C1Cl

InChI

InChI=1S/C12H13ClN2OS/c1-15(9-14)12(16)7-4-8-17-11-6-3-2-5-10(11)13/h2-3,5-6H,4,7-8H2,1H3