5-bromanyl-N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: 5-bromanyl-N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2-methoxy-3-methyl-benzamide Openeye Name: 5-bromo-2-methoxy-3-methyl-N-[[2-methyl-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-2-methoxy-3-methylbenzamide IUPAC Name: 5-bromo-N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl]-2-methoxy-3-methylbenzamide Traditional Name: 5-bromo-2-methoxy-3-methyl-N-[[2-methyl-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]benzamide Formula: C28H28BrN3O3S MolecularWeight: 566.50922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=CC(=CC(=C4OC)C)Br

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)C)NC(=S)NC(=O)C4=CC(=CC(=C4OC)C)Br

InChI

InChI=1S/C28H28BrN3O3S/c1-6-15(2)18-9-10-24-23(12-18)30-27(35-24)19-8-7-16(3)22(13-19)31-28(36)32-26(33)21-14-20(29)11-17(4)25(21)34-5/h7-15H,6H2,1-5H3,(H2,31,32,33,36)