4-[2,4-bis(chloranyl)phenoxy]-N-[(2-methyl-6-propan-2-yl-phenyl)carbamothioyl]butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(2-methyl-6-propan-2-yl-phenyl)carbamothioyl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[(2-isopropyl-6-methyl-phenyl)carbamothioyl]butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[(2-methyl-6-propan-2-ylanilino)-sulfanylidenemethyl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[(2-methyl-6-propan-2-ylphenyl)carbamothioyl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-[(2-isopropyl-6-methyl-phenyl)thiocarbamoyl]butyramide Formula: C21H24Cl2N2O2S MolecularWeight: 439.39846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2O2S/c1-13(2)16-7-4-6-14(3)20(16)25-21(28)24-19(26)8-5-11-27-18-10-9-15(22)12-17(18)23/h4,6-7,9-10,12-13H,5,8,11H2,1-3H3,(H2,24,25,26,28)