2-[2,4-bis(chloranyl)phenoxy]-N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]propanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-[(2-hydroxy-5-sec-butyl-phenyl)carbamothioyl]propanamide CAS Name: N-[(5-butan-2-yl-2-hydroxyanilino)-sulfanylidenemethyl]-2-(2,4-dichlorophenoxy)propanamide IUPAC Name: N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]-2-(2,4-dichlorophenoxy)propanamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[(2-hydroxy-5-sec-butyl-phenyl)thiocarbamoyl]propionamide Formula: C20H22Cl2N2O3S MolecularWeight: 441.37128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C(C)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C20H22Cl2N2O3S/c1-4-11(2)13-5-7-17(25)16(9-13)23-20(28)24-19(26)12(3)27-18-8-6-14(21)10-15(18)22/h5-12,25H,4H2,1-3H3,(H2,23,24,26,28)