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

Systemtic Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]octan-2-one Openeye Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]octan-2-one CAS Name: (1Z)-1-[3-(1-cycloheptenyl)-1,3-benzothiazol-2-ylidene]-2-octanone IUPAC Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]octan-2-one Traditional Name: (1Z)-1-[3-(cyclohepten-1-yl)-1,3-benzothiazol-2-ylidene]octan-2-one Formula: C22H29NOS MolecularWeight: 355.53676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NOS/c1-2-3-4-9-14-19(24)17-22-23(18-12-7-5-6-8-13-18)20-15-10-11-16-21(20)25-22/h10-12,15-17H,2-9,13-14H2,1H3/b22-17-