4-bromanyl-N-[4-(2-ethoxyphenyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 4-bromanyl-N-[4-(2-ethoxyphenyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: 4-bromo-N-[4-(2-ethoxyphenyl)piperazine-1-carbothioyl]benzamide CAS Name: 4-bromo-N-[[4-(2-ethoxyphenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[4-(2-ethoxyphenyl)piperazine-1-carbothioyl]benzamide Traditional Name: 4-bromo-N-(4-o-phenetylpiperazine-1-carbothioyl)benzamide Formula: C20H22BrN3O2S MolecularWeight: 448.37658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrN3O2S/c1-2-26-18-6-4-3-5-17(18)23-11-13-24(14-12-23)20(27)22-19(25)15-7-9-16(21)10-8-15/h3-10H,2,11-14H2,1H3,(H,22,25,27)