N-(4-bromanyl-3-chloranyl-phenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-3-chloranyl-phenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-bromo-3-chloro-phenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(4-bromo-3-chlorophenyl)-4-(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-3-chlorophenyl)-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-bromo-3-chloro-phenyl)-4-o-phenetyl-piperazine-1-carbothioamide Formula: C19H21BrClN3OS MolecularWeight: 454.81154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)Br)Cl

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC(=C(C=C3)Br)Cl

InChI

InChI=1S/C19H21BrClN3OS/c1-2-25-18-6-4-3-5-17(18)23-9-11-24(12-10-23)19(26)22-14-7-8-15(20)16(21)13-14/h3-8,13H,2,9-12H2,1H3,(H,22,26)