N-[[3-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[3-chloranyl-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide CAS Name: N-[[3-chloro-2-(4-ethyl-1-piperazinyl)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[3-chloro-2-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl]hexanamide Traditional Name: N-[[3-chloro-2-(4-ethylpiperazino)phenyl]thiocarbamoyl]hexanamide Formula: C19H29ClN4OS MolecularWeight: 396.97776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=C(C(=CC=C1)Cl)N2CCN(CC2)CC

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=C(C(=CC=C1)Cl)N2CCN(CC2)CC

InChI

InChI=1S/C19H29ClN4OS/c1-3-5-6-10-17(25)22-19(26)21-16-9-7-8-15(20)18(16)24-13-11-23(4-2)12-14-24/h7-9H,3-6,10-14H2,1-2H3,(H2,21,22,25,26)