4-[2,4-bis(chloranyl)phenoxy]-N-[(2-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(2-pyrrolidin-1-ylcarbonylphenyl)carbamothioyl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[[2-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[[2-[oxo(1-pyrrolidinyl)methyl]anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[[2-(pyrrolidine-1-carbonyl)phenyl]carbamothioyl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-[[2-(pyrrolidine-1-carbonyl)phenyl]thiocarbamoyl]butyramide Formula: C22H23Cl2N3O3S MolecularWeight: 480.40732

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H23Cl2N3O3S/c23-15-9-10-19(17(24)14-15)30-13-5-8-20(28)26-22(31)25-18-7-2-1-6-16(18)21(29)27-11-3-4-12-27/h1-2,6-7,9-10,14H,3-5,8,11-13H2,(H2,25,26,28,31)