5-bromanyl-N-[[3-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: 5-bromanyl-N-[[3-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: 5-bromo-2-isobutoxy-N-[[3-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-N-[[3-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: 5-bromo-N-[[3-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: 5-bromo-2-isobutoxy-N-[[3-(4-methylpiperidine-1-carbonyl)phenyl]thiocarbamoyl]benzamide Formula: C25H30BrN3O3S MolecularWeight: 532.493

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)OCC(C)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)OCC(C)C

InChI

InChI=1S/C25H30BrN3O3S/c1-16(2)15-32-22-8-7-19(26)14-21(22)23(30)28-25(33)27-20-6-4-5-18(13-20)24(31)29-11-9-17(3)10-12-29/h4-8,13-14,16-17H,9-12,15H2,1-3H3,(H2,27,28,30,33)