(1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]-3,3-dimethyl-butan-2-one

Systemtic Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]-3,3-dimethyl-butan-2-one Openeye Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]-3,3-dimethyl-butan-2-one CAS Name: (1Z)-1-[3-(1-cycloheptenyl)-1,3-benzothiazol-2-ylidene]-3,3-dimethyl-2-butanone IUPAC Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]-3,3-dimethylbutan-2-one Traditional Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]-3,3-dimethyl-butan-2-one Formula: C20H25NOS MolecularWeight: 327.4836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=C1N(C2=CC=CC=C2S1)C3=CCCCCC3

Isomeric SMILES

CC(C)(C)C(=O)/C=C\1/N(C2=CC=CC=C2S1)C3=CCCCCC3

InChI

InChI=1S/C20H25NOS/c1-20(2,3)18(22)14-19-21(15-10-6-4-5-7-11-15)16-12-8-9-13-17(16)23-19/h8-10,12-14H,4-7,11H2,1-3H3/b19-14-