N-butyl-2-[4-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]piperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]piperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[(2-chloro-4,6-dimethyl-phenyl)carbamothioyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[(2-chloro-4,6-dimethylphenyl)carbamothioyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoyl]piperazino]acetamide Formula: C19H29ClN4OS MolecularWeight: 396.97776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=S)NC2=C(C=C(C=C2Cl)C)C

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=S)NC2=C(C=C(C=C2Cl)C)C

InChI

InChI=1S/C19H29ClN4OS/c1-4-5-6-21-17(25)13-23-7-9-24(10-8-23)19(26)22-18-15(3)11-14(2)12-16(18)20/h11-12H,4-10,13H2,1-3H3,(H,21,25)(H,22,26)