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

Systemtic Name: 2-[4-[(2-chloranyl-4,6-dimethyl-phenyl)carbamothioyl]piperazin-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[(2-chloro-4,6-dimethyl-phenyl)carbamothioyl]piperazin-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]-1-piperazinyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[(2-chloro-4,6-dimethylphenyl)carbamothioyl]piperazin-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoyl]piperazino]-N-isopropyl-acetamide Formula: C18H27ClN4OS MolecularWeight: 382.95118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)N2CCN(CC2)CC(=O)NC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)N2CCN(CC2)CC(=O)NC(C)C)C

InChI

InChI=1S/C18H27ClN4OS/c1-12(2)20-16(24)11-22-5-7-23(8-6-22)18(25)21-17-14(4)9-13(3)10-15(17)19/h9-10,12H,5-8,11H2,1-4H3,(H,20,24)(H,21,25)