N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-2-(phenylthio)nicotinamide Formula: C24H25N3O3S2 MolecularWeight: 467.6036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O3S2/c1-18-12-13-20(32(29,30)27-15-6-3-7-16-27)17-22(18)26-23(28)21-11-8-14-25-24(21)31-19-9-4-2-5-10-19/h2,4-5,8-14,17H,3,6-7,15-16H2,1H3,(H,26,28)