N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]carbamothioyl]-2,3-bis(chloranyl)benzamide

Systemtic Name: N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]carbamothioyl]-2,3-bis(chloranyl)benzamide Openeye Name: 2,3-dichloro-N-[[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]benzamide CAS Name: N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloroanilino]-sulfanylidenemethyl]-2,3-dichlorobenzamide IUPAC Name: N-[[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl]-2,3-dichlorobenzamide Traditional Name: 2,3-dichloro-N-[[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]benzamide Formula: C25H20Cl3N3O2S MolecularWeight: 532.8692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20Cl3N3O2S/c1-3-13(2)14-8-10-21-20(11-14)29-24(33-21)15-7-9-17(26)19(12-15)30-25(34)31-23(32)16-5-4-6-18(27)22(16)28/h4-13H,3H2,1-2H3,(H2,30,31,32,34)