N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[4-(1-piperidylsulfonyl)phenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-(1-piperidinylsulfonyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(4-piperidin-1-ylsulfonylphenyl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-piperidinosulfonylphenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27N3O4S2/c1-2-15-29-19-8-6-7-17(16-19)21(26)24-22(30)23-18-9-11-20(12-10-18)31(27,28)25-13-4-3-5-14-25/h6-12,16H,2-5,13-15H2,1H3,(H2,23,24,26,30)