2-cyano-3-[1-(4-hydroxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: 2-cyano-3-[1-(4-hydroxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: 2-cyano-3-[1-(4-hydroxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: 2-cyano-3-[1-(4-hydroxyphenyl)-2,5-dimethyl-3-pyrrolyl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: 2-cyano-3-[1-(4-hydroxyphenyl)-2,5-dimethylpyrrol-3-yl]-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: 2-cyano-3-[1-(4-hydroxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(6-mesyl-1,3-benzothiazol-2-yl)acrylamide Formula: C24H20N4O4S2 MolecularWeight: 492.57

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)O)C)C=C(C#N)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)O)C)C=C(C#N)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C24H20N4O4S2/c1-14-10-16(15(2)28(14)18-4-6-19(29)7-5-18)11-17(13-25)23(30)27-24-26-21-9-8-20(34(3,31)32)12-22(21)33-24/h4-12,29H,1-3H3,(H,26,27,30)