(6E)-6-(3H-1,3-benzothiazol-2-ylidene)-3-(3,3-dimethyl-4-propan-2-yl-2H-furan-5-yl)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(3H-1,3-benzothiazol-2-ylidene)-3-(3,3-dimethyl-4-propan-2-yl-2H-furan-5-yl)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(3H-1,3-benzothiazol-2-ylidene)-3-(4-isopropyl-3,3-dimethyl-2H-furan-5-yl)cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(3H-1,3-benzothiazol-2-ylidene)-3-(3,3-dimethyl-4-propan-2-yl-2H-furan-5-yl)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(3H-1,3-benzothiazol-2-ylidene)-3-(3,3-dimethyl-4-propan-2-yl-2H-furan-5-yl)cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-(3H-1,3-benzothiazol-2-ylidene)-3-(4-isopropyl-3,3-dimethyl-2H-furan-5-yl)cyclohexa-2,4-dien-1-one Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(OCC1(C)C)C2=CC(=O)C(=C3NC4=CC=CC=C4S3)C=C2

Isomeric SMILES

CC(C)C1=C(OCC1(C)C)C2=CC(=O)/C(=C/3\NC4=CC=CC=C4S3)/C=C2

InChI

InChI=1S/C22H23NO2S/c1-13(2)19-20(25-12-22(19,3)4)14-9-10-15(17(24)11-14)21-23-16-7-5-6-8-18(16)26-21/h5-11,13,23H,12H2,1-4H3/b21-15+