N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-4-formyl-piperazine-1-carbothioamide Formula: C14H18ClN3O3S MolecularWeight: 343.82902

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)N2CCN(CC2)C=O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)N2CCN(CC2)C=O)OC)Cl

InChI

InChI=1S/C14H18ClN3O3S/c1-20-12-8-11(13(21-2)7-10(12)15)16-14(22)18-5-3-17(9-19)4-6-18/h7-9H,3-6H2,1-2H3,(H,16,22)