N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-4-(thiazol-4-ylmethylsulfanyl)benzamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-4-(4-thiazolylmethylthio)benzamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-4-(1,3-thiazol-4-ylmethylsulfanyl)benzamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-4-(thiazol-4-ylmethylthio)benzamide Formula: C23H25N3O3S3 MolecularWeight: 487.6579

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)SCC4=CSC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=C(C=C3)SCC4=CSC=N4

InChI

InChI=1S/C23H25N3O3S3/c1-17-5-10-21(32(28,29)26-11-3-2-4-12-26)13-22(17)25-23(27)18-6-8-20(9-7-18)31-15-19-14-30-16-24-19/h5-10,13-14,16H,2-4,11-12,15H2,1H3,(H,25,27)