2-(4-acetamidophenyl)sulfanyl-N-[(1S)-1-cyano-1-cyclopropyl-ethyl]ethanamide

Systemtic Name: 2-(4-acetamidophenyl)sulfanyl-N-[(1S)-1-cyano-1-cyclopropyl-ethyl]ethanamide Openeye Name: 2-(4-acetamidophenyl)sulfanyl-N-[(1S)-1-cyano-1-cyclopropyl-ethyl]acetamide CAS Name: 2-[(4-acetamidophenyl)thio]-N-[(1S)-1-cyano-1-cyclopropylethyl]acetamide IUPAC Name: 2-(4-acetamidophenyl)sulfanyl-N-[(1S)-1-cyano-1-cyclopropylethyl]acetamide Traditional Name: 2-[(4-acetamidophenyl)thio]-N-[(1S)-1-cyano-1-cyclopropyl-ethyl]acetamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)NC(C)(C#N)C2CC2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)N[C@](C)(C#N)C2CC2

InChI

InChI=1S/C16H19N3O2S/c1-11(20)18-13-5-7-14(8-6-13)22-9-15(21)19-16(2,10-17)12-3-4-12/h5-8,12H,3-4,9H2,1-2H3,(H,18,20)(H,19,21)/t16-/m1/s1