3,5-bis(bromanyl)-2-methoxy-N-[[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-bis(bromanyl)-2-methoxy-N-[[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dibromo-2-methoxy-N-[[4-(4-methyl-1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dibromo-2-methoxy-N-[[4-(4-methyl-1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dibromo-2-methoxy-N-[[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3,5-dibromo-2-methoxy-N-[[4-(4-methylpiperidino)phenyl]thiocarbamoyl]benzamide Formula: C21H23Br2N3O2S MolecularWeight: 541.29922

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC(=C3OC)Br)Br

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=CC(=C3OC)Br)Br

InChI

InChI=1S/C21H23Br2N3O2S/c1-13-7-9-26(10-8-13)16-5-3-15(4-6-16)24-21(29)25-20(27)17-11-14(22)12-18(23)19(17)28-2/h3-6,11-13H,7-10H2,1-2H3,(H2,24,25,27,29)