4-[[2-(1,3-benzothiazol-2-yl)ethylamino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one

Systemtic Name: 4-[[2-(1,3-benzothiazol-2-yl)ethylamino]methylidene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one Openeye Name: 4-[[2-(1,3-benzothiazol-2-yl)ethylamino]methylene]-5-(hydroxymethyl)-2-methyl-pyridin-3-one CAS Name: 4-[[2-(1,3-benzothiazol-2-yl)ethylamino]methylidene]-5-(hydroxymethyl)-2-methyl-3-pyridinone IUPAC Name: 4-[[2-(1,3-benzothiazol-2-yl)ethylamino]methylidene]-5-(hydroxymethyl)-2-methylpyridin-3-one Traditional Name: 4-[[2-(1,3-benzothiazol-2-yl)ethylamino]methylene]-2-methyl-5-methylol-pyridin-3-one Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNCCC2=NC3=CC=CC=C3S2)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNCCC2=NC3=CC=CC=C3S2)C1=O)CO

InChI

InChI=1S/C17H17N3O2S/c1-11-17(22)13(12(10-21)8-19-11)9-18-7-6-16-20-14-4-2-3-5-15(14)23-16/h2-5,8-9,18,21H,6-7,10H2,1H3