N-[4-chloranyl-2-[3-(1-cyanoethyl)-1-sulfanylidene-nonan-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-chloranyl-2-[3-(1-cyanoethyl)-1-sulfanylidene-nonan-2-yl]phenyl]ethanamide Openeye Name: N-[4-chloro-2-[2-(1-cyanoethyl)-1-methanethioyl-octyl]phenyl]acetamide CAS Name: N-[4-chloro-2-[3-(1-cyanoethyl)-1-sulfanylidenenonan-2-yl]phenyl]acetamide IUPAC Name: N-[4-chloro-2-[3-(1-cyanoethyl)-1-sulfanylidenenonan-2-yl]phenyl]acetamide Traditional Name: N-[4-chloro-2-[2-(1-cyanoethyl)-1-thioformyl-octyl]phenyl]acetamide Formula: C20H27ClN2OS MolecularWeight: 378.95918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)C#N)C(C=S)C1=C(C=CC(=C1)Cl)NC(=O)C

Isomeric SMILES

CCCCCCC(C(C)C#N)C(C=S)C1=C(C=CC(=C1)Cl)NC(=O)C

InChI

InChI=1S/C20H27ClN2OS/c1-4-5-6-7-8-17(14(2)12-22)19(13-25)18-11-16(21)9-10-20(18)23-15(3)24/h9-11,13-14,17,19H,4-8H2,1-3H3,(H,23,24)