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

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(4-cyanophenyl)carbamothioyl]butanamide Openeye Name: N-[(4-cyanophenyl)carbamothioyl]-4-(2,4-dichlorophenoxy)butanamide CAS Name: N-[(4-cyanoanilino)-sulfanylidenemethyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: N-[(4-cyanophenyl)carbamothioyl]-4-(2,4-dichlorophenoxy)butanamide Traditional Name: N-[(4-cyanophenyl)thiocarbamoyl]-4-(2,4-dichlorophenoxy)butyramide Formula: C18H15Cl2N3O2S MolecularWeight: 408.3016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H15Cl2N3O2S/c19-13-5-8-16(15(20)10-13)25-9-1-2-17(24)23-18(26)22-14-6-3-12(11-21)4-7-14/h3-8,10H,1-2,9H2,(H2,22,23,24,26)