3-(1,3-benzothiazol-2-yl)-4,5,5-trimethyl-furan-2-one

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-4,5,5-trimethyl-furan-2-one Openeye Name: 3-(1,3-benzothiazol-2-yl)-4,5,5-trimethyl-furan-2-one CAS Name: 3-(1,3-benzothiazol-2-yl)-4,5,5-trimethyl-2-furanone IUPAC Name: 3-(1,3-benzothiazol-2-yl)-4,5,5-trimethylfuran-2-one Traditional Name: 3-(1,3-benzothiazol-2-yl)-4,5,5-trimethyl-furan-2-one Formula: C14H13NO2S MolecularWeight: 259.32352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC1(C)C)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C(=O)OC1(C)C)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H13NO2S/c1-8-11(13(16)17-14(8,2)3)12-15-9-6-4-5-7-10(9)18-12/h4-7H,1-3H3