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

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(4-phenylazanylphenyl)carbamothioyl]butanamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-4-(2,4-dichlorophenoxy)butanamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-4-(2,4-dichlorophenoxy)butanamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-4-(2,4-dichlorophenoxy)butyramide Formula: C23H21Cl2N3O2S MolecularWeight: 474.40274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H21Cl2N3O2S/c24-16-8-13-21(20(25)15-16)30-14-4-7-22(29)28-23(31)27-19-11-9-18(10-12-19)26-17-5-2-1-3-6-17/h1-3,5-6,8-13,15,26H,4,7,14H2,(H2,27,28,29,31)