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

Systemtic Name: 3-bromanyl-N-[[4-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-4-(2-methylpropoxy)benzamide Openeye Name: 3-bromo-4-isobutoxy-N-[[4-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[4-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: 3-bromo-N-[[4-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-4-(2-methylpropoxy)benzamide Traditional Name: 3-bromo-4-isobutoxy-N-[[4-(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=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OCC(C)C)Br

Isomeric SMILES

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

InChI

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