N-[[2-chloranyl-5-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[[2-chloranyl-5-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2,4-dimethyl-benzamide Openeye Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2,4-dimethyl-benzamide CAS Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]-2,4-dimethylbenzamide IUPAC Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2,4-dimethylbenzamide Traditional Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]-2,4-dimethyl-benzamide Formula: C23H17Cl2N3O2S MolecularWeight: 470.37098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)Cl)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)Cl)Cl)C

InChI

InChI=1S/C23H17Cl2N3O2S/c1-12-3-6-16(13(2)9-12)21(29)28-23(31)27-18-10-14(4-7-17(18)25)22-26-19-11-15(24)5-8-20(19)30-22/h3-11H,1-2H3,(H2,27,28,29,31)