N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-[[2-(1-piperidylsulfonyl)phenyl]methyl]-4-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-4-(4-thiazolylmethylthio)benzamide IUPAC Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(2-piperidinosulfonylbenzyl)-4-(thiazol-4-ylmethylthio)benzamide Formula: C23H25N3O3S3 MolecularWeight: 487.6579

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CC=C(C=C3)SCC4=CSC=N4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNC(=O)C3=CC=C(C=C3)SCC4=CSC=N4

InChI

InChI=1S/C23H25N3O3S3/c27-23(18-8-10-21(11-9-18)31-16-20-15-30-17-25-20)24-14-19-6-2-3-7-22(19)32(28,29)26-12-4-1-5-13-26/h2-3,6-11,15,17H,1,4-5,12-14,16H2,(H,24,27)