5-bromanyl-2-methoxy-3-methyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-3-methyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-methoxy-3-methyl-N-[[2-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-methoxy-3-methyl-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-methoxy-3-methyl-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-methoxy-3-methyl-N-[(2-piperidinophenyl)thiocarbamoyl]benzamide Formula: C21H24BrN3O2S MolecularWeight: 462.40316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3)OC

InChI

InChI=1S/C21H24BrN3O2S/c1-14-12-15(22)13-16(19(14)27-2)20(26)24-21(28)23-17-8-4-5-9-18(17)25-10-6-3-7-11-25/h4-5,8-9,12-13H,3,6-7,10-11H2,1-2H3,(H2,23,24,26,28)