2-(2-azanyl-6-chloranyl-phenyl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide

Systemtic Name: 2-(2-azanyl-6-chloranyl-phenyl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide Openeye Name: 2-(2-amino-6-chloro-phenyl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide CAS Name: 2-[(2-amino-6-chlorophenyl)thio]-N,N-bis(2-cyanoethyl)acetamide IUPAC Name: 2-(2-amino-6-chlorophenyl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide Traditional Name: 2-[(2-amino-6-chloro-phenyl)thio]-N,N-bis(2-cyanoethyl)acetamide Formula: C14H15ClN4OS MolecularWeight: 322.8131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)SCC(=O)N(CCC#N)CCC#N)N

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)SCC(=O)N(CCC#N)CCC#N)N

InChI

InChI=1S/C14H15ClN4OS/c15-11-4-1-5-12(18)14(11)21-10-13(20)19(8-2-6-16)9-3-7-17/h1,4-5H,2-3,8-10,18H2