N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxidanylidene-butanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxidanylidene-butanamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxo-butanamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxobutanamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-oxobutanamide Traditional Name: 3-keto-N-(4-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC(=O)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CC(=O)C

InChI

InChI=1S/C12H12N2O2S/c1-7-4-3-5-9-11(7)14-12(17-9)13-10(16)6-8(2)15/h3-5H,6H2,1-2H3,(H,13,14,16)