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

Systemtic Name: N-[(4-butylphenyl)carbamothioyl]-4-(4-chloranylphenoxy)butanamide Openeye Name: N-[(4-butylphenyl)carbamothioyl]-4-(4-chlorophenoxy)butanamide CAS Name: N-[(4-butylanilino)-sulfanylidenemethyl]-4-(4-chlorophenoxy)butanamide IUPAC Name: N-[(4-butylphenyl)carbamothioyl]-4-(4-chlorophenoxy)butanamide Traditional Name: N-[(4-butylphenyl)thiocarbamoyl]-4-(4-chlorophenoxy)butyramide Formula: C21H25ClN2O2S MolecularWeight: 404.9534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)CCCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC(=O)CCCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O2S/c1-2-3-5-16-7-11-18(12-8-16)23-21(27)24-20(25)6-4-15-26-19-13-9-17(22)10-14-19/h7-14H,2-6,15H2,1H3,(H2,23,24,25,27)