4-(4-chloranylphenoxy)-N-[(4-pentoxyphenyl)carbamothioyl]butanamide

Systemtic Name: 4-(4-chloranylphenoxy)-N-[(4-pentoxyphenyl)carbamothioyl]butanamide Openeye Name: 4-(4-chlorophenoxy)-N-[(4-pentoxyphenyl)carbamothioyl]butanamide CAS Name: 4-(4-chlorophenoxy)-N-[(4-pentoxyanilino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(4-chlorophenoxy)-N-[(4-pentoxyphenyl)carbamothioyl]butanamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-4-(4-chlorophenoxy)butyramide Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)CCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)CCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H27ClN2O3S/c1-2-3-4-15-27-20-13-9-18(10-14-20)24-22(29)25-21(26)6-5-16-28-19-11-7-17(23)8-12-19/h7-14H,2-6,15-16H2,1H3,(H2,24,25,26,29)