N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-3-methyl-butanamide CAS Name: N-[[[4-(2,4-dichlorophenoxy)-1-oxobutyl]hydrazo]-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]carbamothioyl]-3-methylbutanamide Traditional Name: N-[[4-(2,4-dichlorophenoxy)butanoylamino]thiocarbamoyl]-3-methyl-butyramide Formula: C16H21Cl2N3O3S MolecularWeight: 406.32724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NNC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C)CC(=O)NC(=S)NNC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H21Cl2N3O3S/c1-10(2)8-15(23)19-16(25)21-20-14(22)4-3-7-24-13-6-5-11(17)9-12(13)18/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,20,22)(H2,19,21,23,25)