2-(4-azanyl-2-chloranyl-phenyl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide

Systemtic Name: 2-(4-azanyl-2-chloranyl-phenyl)sulfanyl-N,N-bis(2-cyanoethyl)ethanamide Openeye Name: 2-(4-amino-2-chloro-phenyl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide CAS Name: 2-[(4-amino-2-chlorophenyl)thio]-N,N-bis(2-cyanoethyl)acetamide IUPAC Name: 2-(4-amino-2-chlorophenyl)sulfanyl-N,N-bis(2-cyanoethyl)acetamide Traditional Name: 2-[(4-amino-2-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=C1N)Cl)SCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC(=C(C=C1N)Cl)SCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C14H15ClN4OS/c15-12-9-11(18)3-4-13(12)21-10-14(20)19(7-1-5-16)8-2-6-17/h3-4,9H,1-2,7-8,10,18H2