4-(2-ethyl-2H-1,3-benzothiazol-3-yl)butan-2-one

Systemtic Name: 4-(2-ethyl-2H-1,3-benzothiazol-3-yl)butan-2-one Openeye Name: 4-(2-ethyl-2H-1,3-benzothiazol-3-yl)butan-2-one CAS Name: 4-(2-ethyl-2H-1,3-benzothiazol-3-yl)-2-butanone IUPAC Name: 4-(2-ethyl-2H-1,3-benzothiazol-3-yl)butan-2-one Traditional Name: 4-(2-ethyl-2H-1,3-benzothiazol-3-yl)butan-2-one Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

CCC1N(C2=CC=CC=C2S1)CCC(=O)C

Isomeric SMILES

CCC1N(C2=CC=CC=C2S1)CCC(=O)C

InChI

InChI=1S/C13H17NOS/c1-3-13-14(9-8-10(2)15)11-6-4-5-7-12(11)16-13/h4-7,13H,3,8-9H2,1-2H3