4-[[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one

Systemtic Name: 4-[[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one Openeye Name: 4-[[4-(1,3-benzothiazol-2-ylmethyl)anilino]methylene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one CAS Name: 4-[[4-(1,3-benzothiazol-2-ylmethyl)anilino]methylidene]-5-(hydroxymethyl)-2-methyl-3-pyridinone IUPAC Name: 4-[[4-(1,3-benzothiazol-2-ylmethyl)anilino]methylidene]-5-(hydroxymethyl)-2-methylpyridin-3-one Traditional Name: 4-[[4-(1,3-benzothiazol-2-ylmethyl)anilino]methylene]-2-methyl-5-methylol-pyridin-3-one Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3)C1=O)CO

InChI

InChI=1S/C22H19N3O2S/c1-14-22(27)18(16(13-26)11-23-14)12-24-17-8-6-15(7-9-17)10-21-25-19-4-2-3-5-20(19)28-21/h2-9,11-12,24,26H,10,13H2,1H3