N-(2-chloranyl-4,6-dimethyl-phenyl)-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-4-formyl-piperazine-1-carbothioamide Formula: C14H18ClN3OS MolecularWeight: 311.83022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18ClN3OS/c1-10-7-11(2)13(12(15)8-10)16-14(20)18-5-3-17(9-19)4-6-18/h7-9H,3-6H2,1-2H3,(H,16,20)