5-(hydroxymethyl)-2-methyl-4-[[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]methylidene]pyridin-3-one

Systemtic Name: 5-(hydroxymethyl)-2-methyl-4-[[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)amino]methylidene]pyridin-3-one Openeye Name: 5-(hydroxymethyl)-2-methyl-4-[[4-methyl-3-(1-piperidylsulfonyl)anilino]methylene]pyridin-3-one CAS Name: 5-(hydroxymethyl)-2-methyl-4-[[4-methyl-3-(1-piperidinylsulfonyl)anilino]methylidene]-3-pyridinone IUPAC Name: 5-(hydroxymethyl)-2-methyl-4-[(4-methyl-3-piperidin-1-ylsulfonylanilino)methylidene]pyridin-3-one Traditional Name: 2-methyl-5-methylol-4-[(4-methyl-3-piperidinosulfonyl-anilino)methylene]pyridin-3-one Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC=C2C(=CN=C(C2=O)C)CO)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC=C2C(=CN=C(C2=O)C)CO)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H25N3O4S/c1-14-6-7-17(10-19(14)28(26,27)23-8-4-3-5-9-23)22-12-18-16(13-24)11-21-15(2)20(18)25/h6-7,10-12,22,24H,3-5,8-9,13H2,1-2H3