(E)-2-cyano-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)acrylamide Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C(=CC3=CC=C(C=C3)OC)C#N)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)/C(=C/C3=CC=C(C=C3)OC)/C#N)C

InChI

InChI=1S/C20H17N3O2S/c1-12-8-13(2)18-17(9-12)26-20(22-18)23-19(24)15(11-21)10-14-4-6-16(25-3)7-5-14/h4-10H,1-3H3,(H,22,23,24)/b15-10+