2-(1,3-benzothiazol-2-yl)-2-[1-(2-methoxy-5-nitro-phenyl)-2,6-dimethyl-pyridin-4-ylidene]ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-[1-(2-methoxy-5-nitro-phenyl)-2,6-dimethyl-pyridin-4-ylidene]ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-[1-(2-methoxy-5-nitro-phenyl)-2,6-dimethyl-4-pyridylidene]acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-[1-(2-methoxy-5-nitrophenyl)-2,6-dimethyl-4-pyridinylidene]acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-[1-(2-methoxy-5-nitrophenyl)-2,6-dimethylpyridin-4-ylidene]acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-[1-(2-methoxy-5-nitro-phenyl)-2,6-dimethyl-4-pyridylidene]acetonitrile Formula: C23H18N4O3S MolecularWeight: 430.47902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1C4=C(C=CC(=C4)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1C4=C(C=CC(=C4)[N+](=O)[O-])OC)C

InChI

InChI=1S/C23H18N4O3S/c1-14-10-16(18(13-24)23-25-19-6-4-5-7-22(19)31-23)11-15(2)26(14)20-12-17(27(28)29)8-9-21(20)30-3/h4-12H,1-3H3