4-[2,4-bis(chloranyl)phenoxy]-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-[[4-(1-piperidyl)phenyl]carbamothioyl]butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-[(4-piperidinophenyl)thiocarbamoyl]butyramide Formula: C22H25Cl2N3O2S MolecularWeight: 466.4238

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O2S/c23-16-6-11-20(19(24)15-16)29-14-4-5-21(28)26-22(30)25-17-7-9-18(10-8-17)27-12-2-1-3-13-27/h6-11,15H,1-5,12-14H2,(H2,25,26,28,30)