(2E)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-phenyl-butane-1,3-dione

Systemtic Name: (2E)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-phenyl-butane-1,3-dione Openeye Name: (2E)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-phenyl-butane-1,3-dione CAS Name: (2E)-2-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)-1-phenylbutane-1,3-dione IUPAC Name: (2E)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-phenylbutane-1,3-dione Traditional Name: (2E)-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-1-phenyl-butane-1,3-dione Formula: C22H17NO2S MolecularWeight: 359.44088

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1N(C2=C(S1)C=CC3=CC=CC=C32)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)/C(=C\1/N(C2=C(S1)C=CC3=CC=CC=C32)C)/C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H17NO2S/c1-14(24)19(21(25)16-9-4-3-5-10-16)22-23(2)20-17-11-7-6-8-15(17)12-13-18(20)26-22/h3-13H,1-2H3/b22-19+