2-phenethyloxy-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-phenethyloxy-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]benzamide Openeye Name: 2-phenethyloxy-N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]benzamide CAS Name: 2-phenethyloxy-N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-phenethyloxy-N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]benzamide Traditional Name: 2-phenethyloxy-N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C27H29N3O4S2 MolecularWeight: 523.66686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3OCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=CC=C3OCCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O4S2/c31-26(24-11-5-6-12-25(24)34-20-17-21-9-3-1-4-10-21)29-27(35)28-22-13-15-23(16-14-22)36(32,33)30-18-7-2-8-19-30/h1,3-6,9-16H,2,7-8,17-20H2,(H2,28,29,31,35)