3-bromanyl-4-ethoxy-N-(4-methylpiperidin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-(4-methylpiperidin-1-yl)carbothioyl-benzamide Openeye Name: 3-bromo-4-ethoxy-N-(4-methylpiperidine-1-carbothioyl)benzamide CAS Name: 3-bromo-4-ethoxy-N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-(4-methylpiperidine-1-carbothioyl)benzamide Traditional Name: 3-bromo-4-ethoxy-N-(4-methylpiperidine-1-carbothioyl)benzamide Formula: C16H21BrN2O2S MolecularWeight: 385.31914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCC(CC2)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCC(CC2)C)Br

InChI

InChI=1S/C16H21BrN2O2S/c1-3-21-14-5-4-12(10-13(14)17)15(20)18-16(22)19-8-6-11(2)7-9-19/h4-5,10-11H,3,6-9H2,1-2H3,(H,18,20,22)