2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyridin-4-ylidene]ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyridin-4-ylidene]ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(3-morpholinosulfonylphenyl)-4-pyridylidene]acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-[3-(4-morpholinylsulfonyl)phenyl]-4-pyridinylidene]acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(3-morpholin-4-ylsulfonylphenyl)pyridin-4-ylidene]acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-[2,6-dimethyl-1-(3-morpholinosulfonylphenyl)-4-pyridylidene]acetonitrile Formula: C26H24N4O3S2 MolecularWeight: 504.62376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5)C

Isomeric SMILES

CC1=CC(=C(C#N)C2=NC3=CC=CC=C3S2)C=C(N1C4=CC(=CC=C4)S(=O)(=O)N5CCOCC5)C

InChI

InChI=1S/C26H24N4O3S2/c1-18-14-20(23(17-27)26-28-24-8-3-4-9-25(24)34-26)15-19(2)30(18)21-6-5-7-22(16-21)35(31,32)29-10-12-33-13-11-29/h3-9,14-16H,10-13H2,1-2H3