4-(4-chloranylphenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide

Systemtic Name: 4-(4-chloranylphenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide Openeye Name: 4-(4-chlorophenoxy)-N-[[4-(1-piperidyl)phenyl]carbamothioyl]butanamide CAS Name: 4-(4-chlorophenoxy)-N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: 4-(4-chlorophenoxy)-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide Traditional Name: 4-(4-chlorophenoxy)-N-[(4-piperidinophenyl)thiocarbamoyl]butyramide Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26ClN3O2S/c23-17-6-12-20(13-7-17)28-16-4-5-21(27)25-22(29)24-18-8-10-19(11-9-18)26-14-2-1-3-15-26/h6-13H,1-5,14-16H2,(H2,24,25,27,29)