ethyl 2-cyano-2-[2,6-dimethyl-1-[4-(2-methyl-1,3-benzothiazol-6-yl)phenyl]pyridin-4-ylidene]ethanoate

Systemtic Name: ethyl 2-cyano-2-[2,6-dimethyl-1-[4-(2-methyl-1,3-benzothiazol-6-yl)phenyl]pyridin-4-ylidene]ethanoate Openeye Name: ethyl 2-cyano-2-[2,6-dimethyl-1-[4-(2-methyl-1,3-benzothiazol-6-yl)phenyl]-4-pyridylidene]acetate CAS Name: 2-cyano-2-[2,6-dimethyl-1-[4-(2-methyl-1,3-benzothiazol-6-yl)phenyl]-4-pyridinylidene]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-[2,6-dimethyl-1-[4-(2-methyl-1,3-benzothiazol-6-yl)phenyl]pyridin-4-ylidene]acetate Traditional Name: 2-cyano-2-[2,6-dimethyl-1-[4-(2-methyl-1,3-benzothiazol-6-yl)phenyl]-4-pyridylidene]acetic acid ethyl ester Formula: C26H23N3O2S MolecularWeight: 441.54472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C=C(N(C(=C1)C)C2=CC=C(C=C2)C3=CC4=C(C=C3)N=C(S4)C)C)C#N

Isomeric SMILES

CCOC(=O)C(=C1C=C(N(C(=C1)C)C2=CC=C(C=C2)C3=CC4=C(C=C3)N=C(S4)C)C)C#N

InChI

InChI=1S/C26H23N3O2S/c1-5-31-26(30)23(15-27)21-12-16(2)29(17(3)13-21)22-9-6-19(7-10-22)20-8-11-24-25(14-20)32-18(4)28-24/h6-14H,5H2,1-4H3