(2Z)-4-bromanyl-7-methyl-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-3H-inden-1-one

Systemtic Name: (2Z)-4-bromanyl-7-methyl-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-3H-inden-1-one Openeye Name: (2Z)-4-bromo-7-methyl-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)indan-1-one CAS Name: (2Z)-4-bromo-7-methyl-2-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)-3H-inden-1-one IUPAC Name: (2Z)-4-bromo-7-methyl-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-3H-inden-1-one Traditional Name: (2Z)-4-bromo-7-methyl-2-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)indan-1-one Formula: C22H16BrNOS MolecularWeight: 422.33754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Br)CC(=C3N(C4=C(S3)C=CC5=CC=CC=C54)C)C2=O

Isomeric SMILES

CC1=C2C(=C(C=C1)Br)C/C(=C/3\N(C4=C(S3)C=CC5=CC=CC=C54)C)/C2=O

InChI

InChI=1S/C22H16BrNOS/c1-12-7-9-17(23)15-11-16(21(25)19(12)15)22-24(2)20-14-6-4-3-5-13(14)8-10-18(20)26-22/h3-10H,11H2,1-2H3/b22-16-