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

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(phenylcarbamothioylamino)carbamothioyl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[(phenylcarbamothioylamino)carbamothioyl]butanamide CAS Name: N-[[[anilino(sulfanylidene)methyl]hydrazo]-sulfanylidenemethyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[(phenylcarbamothioylamino)carbamothioyl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-[(phenylthiocarbamoylamino)thiocarbamoyl]butyramide Formula: C18H18Cl2N4O2S2 MolecularWeight: 457.39712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N4O2S2/c19-12-8-9-15(14(20)11-12)26-10-4-7-16(25)22-18(28)24-23-17(27)21-13-5-2-1-3-6-13/h1-3,5-6,8-9,11H,4,7,10H2,(H2,21,23,27)(H2,22,24,25,28)