2-[4-(5-chloranylthiophen-2-yl)phenyl]sulfanyl-N-(cyanomethyl)-4-methyl-pentanamide

Systemtic Name: 2-[4-(5-chloranylthiophen-2-yl)phenyl]sulfanyl-N-(cyanomethyl)-4-methyl-pentanamide Openeye Name: 2-[4-(5-chloro-2-thienyl)phenyl]sulfanyl-N-(cyanomethyl)-4-methyl-pentanamide CAS Name: 2-[[4-(5-chloro-2-thiophenyl)phenyl]thio]-N-(cyanomethyl)-4-methylpentanamide IUPAC Name: 2-[4-(5-chlorothiophen-2-yl)phenyl]sulfanyl-N-(cyanomethyl)-4-methylpentanamide Traditional Name: 2-[[4-(5-chloro-2-thienyl)phenyl]thio]-N-(cyanomethyl)-4-methyl-valeramide Formula: C18H19ClN2OS2 MolecularWeight: 378.93926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC#N)SC1=CC=C(C=C1)C2=CC=C(S2)Cl

Isomeric SMILES

CC(C)CC(C(=O)NCC#N)SC1=CC=C(C=C1)C2=CC=C(S2)Cl

InChI

InChI=1S/C18H19ClN2OS2/c1-12(2)11-16(18(22)21-10-9-20)23-14-5-3-13(4-6-14)15-7-8-17(19)24-15/h3-8,12,16H,10-11H2,1-2H3,(H,21,22)