2-[2,4-bis(chloranyl)phenoxy]-N-[[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]propanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-[[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]propanamide CAS Name: 2-(2,4-dichlorophenoxy)-N-[[[2-(4-fluorophenyl)-6-methyl-5-benzotriazolyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: 2-(2,4-dichlorophenoxy)-N-[[2-(4-fluorophenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]propanamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[[2-(4-fluorophenyl)-6-methyl-benzotriazol-5-yl]thiocarbamoyl]propionamide Formula: C23H18Cl2FN5O2S MolecularWeight: 518.390723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C(C)OC3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H18Cl2FN5O2S/c1-12-9-19-20(30-31(29-19)16-6-4-15(26)5-7-16)11-18(12)27-23(34)28-22(32)13(2)33-21-8-3-14(24)10-17(21)25/h3-11,13H,1-2H3,(H2,27,28,32,34)