2-(2-bromanyl-4-ethyl-phenoxy)-N-(4-methylpiperidin-1-yl)carbothioyl-ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-(4-methylpiperidin-1-yl)carbothioyl-ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(4-methylpiperidine-1-carbothioyl)acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-(4-methylpiperidine-1-carbothioyl)acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(4-methylpiperidine-1-carbothioyl)acetamide Formula: C17H23BrN2O2S MolecularWeight: 399.34572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)N2CCC(CC2)C)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)N2CCC(CC2)C)Br

InChI

InChI=1S/C17H23BrN2O2S/c1-3-13-4-5-15(14(18)10-13)22-11-16(21)19-17(23)20-8-6-12(2)7-9-20/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,19,21,23)