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

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(5-chloro-2-methylphenyl)-N-(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N-(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N-o-phenetyl-piperazine-1-carbothioamide Formula: C20H24ClN3OS MolecularWeight: 389.94206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C20H24ClN3OS/c1-3-25-19-7-5-4-6-17(19)22-20(26)24-12-10-23(11-13-24)18-14-16(21)9-8-15(18)2/h4-9,14H,3,10-13H2,1-2H3,(H,22,26)