3-bromanyl-N-[3-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylpropyl]benzamide

Systemtic Name: 3-bromanyl-N-[3-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylpropyl]benzamide Openeye Name: 3-bromo-N-[3-[1-ethyl-4,5-bis(p-tolyl)imidazol-2-yl]sulfanylpropyl]benzamide CAS Name: 3-bromo-N-[3-[[1-ethyl-4,5-bis(4-methylphenyl)-2-imidazolyl]thio]propyl]benzamide IUPAC Name: 3-bromo-N-[3-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylpropyl]benzamide Traditional Name: 3-bromo-N-[3-[[1-ethyl-4,5-bis(p-tolyl)imidazol-2-yl]thio]propyl]benzamide Formula: C29H30BrN3OS MolecularWeight: 548.537

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCNC(=O)C2=CC(=CC=C2)Br)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C(=C(N=C1SCCCNC(=O)C2=CC(=CC=C2)Br)C3=CC=C(C=C3)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C29H30BrN3OS/c1-4-33-27(23-15-11-21(3)12-16-23)26(22-13-9-20(2)10-14-22)32-29(33)35-18-6-17-31-28(34)24-7-5-8-25(30)19-24/h5,7-16,19H,4,6,17-18H2,1-3H3,(H,31,34)