2-(4-azanyl-2-methyl-phenyl)sulfanyl-N-(2-cyanoethyl)ethanamide

Systemtic Name: 2-(4-azanyl-2-methyl-phenyl)sulfanyl-N-(2-cyanoethyl)ethanamide Openeye Name: 2-(4-amino-2-methyl-phenyl)sulfanyl-N-(2-cyanoethyl)acetamide CAS Name: 2-[(4-amino-2-methylphenyl)thio]-N-(2-cyanoethyl)acetamide IUPAC Name: 2-(4-amino-2-methylphenyl)sulfanyl-N-(2-cyanoethyl)acetamide Traditional Name: 2-[(4-amino-2-methyl-phenyl)thio]-N-(2-cyanoethyl)acetamide Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC(=O)NCCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC(=O)NCCC#N

InChI

InChI=1S/C12H15N3OS/c1-9-7-10(14)3-4-11(9)17-8-12(16)15-6-2-5-13/h3-4,7H,2,6,8,14H2,1H3,(H,15,16)