4-[2,4-bis(chloranyl)phenoxy]-N-[(3-hexoxyphenyl)carbamothioyl]butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(3-hexoxyphenyl)carbamothioyl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[(3-hexoxyphenyl)carbamothioyl]butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[(3-hexoxyanilino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[(3-hexoxyphenyl)carbamothioyl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-[(3-hexoxyphenyl)thiocarbamoyl]butyramide Formula: C23H28Cl2N2O3S MolecularWeight: 483.45102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C23H28Cl2N2O3S/c1-2-3-4-5-13-29-19-9-6-8-18(16-19)26-23(31)27-22(28)10-7-14-30-21-12-11-17(24)15-20(21)25/h6,8-9,11-12,15-16H,2-5,7,10,13-14H2,1H3,(H2,26,27,28,31)