2-[1,3-benzothiazol-2-yl-[1-(4-iodophenyl)-2,6-dimethyl-pyridin-4-ylidene]methyl]-1,3-benzothiazole

Systemtic Name: 2-[1,3-benzothiazol-2-yl-[1-(4-iodophenyl)-2,6-dimethyl-pyridin-4-ylidene]methyl]-1,3-benzothiazole Openeye Name: 2-[1,3-benzothiazol-2-yl-[1-(4-iodophenyl)-2,6-dimethyl-4-pyridylidene]methyl]-1,3-benzothiazole CAS Name: 2-[1,3-benzothiazol-2-yl-[1-(4-iodophenyl)-2,6-dimethyl-4-pyridinylidene]methyl]-1,3-benzothiazole IUPAC Name: 2-[1,3-benzothiazol-2-yl-[1-(4-iodophenyl)-2,6-dimethylpyridin-4-ylidene]methyl]-1,3-benzothiazole Traditional Name: 2-[1,3-benzothiazol-2-yl-[1-(4-iodophenyl)-2,6-dimethyl-4-pyridylidene]methyl]-1,3-benzothiazole Formula: C28H20IN3S2 MolecularWeight: 589.51297

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4)C=C(N1C6=CC=C(C=C6)I)C

Isomeric SMILES

CC1=CC(=C(C2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4)C=C(N1C6=CC=C(C=C6)I)C

InChI

InChI=1S/C28H20IN3S2/c1-17-15-19(16-18(2)32(17)21-13-11-20(29)12-14-21)26(27-30-22-7-3-5-9-24(22)33-27)28-31-23-8-4-6-10-25(23)34-28/h3-16H,1-2H3