N-(5-chloranyl-2-methoxy-phenyl)-4-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-methyl-piperazine-1-carbothioamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-methyl-piperazine-1-carbothioamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-methylpiperazine-1-carbothioamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-methyl-piperazine-1-carbothioamide Formula: C13H18ClN3OS MolecularWeight: 299.81952

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)NC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CN1CCN(CC1)C(=S)NC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C13H18ClN3OS/c1-16-5-7-17(8-6-16)13(19)15-11-9-10(14)3-4-12(11)18-2/h3-4,9H,5-8H2,1-2H3,(H,15,19)