N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-2-(4-propan-2-ylphenoxy)ethanamide

Systemtic Name: N-[(3-chloranyl-4-piperidin-1-yl-phenyl)carbamothioyl]-2-(4-propan-2-ylphenoxy)ethanamide Openeye Name: N-[[3-chloro-4-(1-piperidyl)phenyl]carbamothioyl]-2-(4-isopropylphenoxy)acetamide CAS Name: N-[[3-chloro-4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-2-(4-propan-2-ylphenoxy)acetamide IUPAC Name: N-[(3-chloro-4-piperidin-1-ylphenyl)carbamothioyl]-2-(4-propan-2-ylphenoxy)acetamide Traditional Name: N-[(3-chloro-4-piperidino-phenyl)thiocarbamoyl]-2-(4-isopropylphenoxy)acetamide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCCC3)Cl

InChI

InChI=1S/C23H28ClN3O2S/c1-16(2)17-6-9-19(10-7-17)29-15-22(28)26-23(30)25-18-8-11-21(20(24)14-18)27-12-4-3-5-13-27/h6-11,14,16H,3-5,12-13,15H2,1-2H3,(H2,25,26,28,30)