(E)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)-N-[4-(p-tolyl)thiazol-2-yl]prop-2-enamide CAS Name: (E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-[4-(4-methylphenyl)-2-thiazolyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-hexoxy-3-methoxyphenyl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-hexoxy-3-methoxy-phenyl)-N-[4-(p-tolyl)thiazol-2-yl]acrylamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C)OC

InChI

InChI=1S/C27H29N3O3S/c1-4-5-6-7-14-33-24-13-10-20(16-25(24)32-3)15-22(17-28)26(31)30-27-29-23(18-34-27)21-11-8-19(2)9-12-21/h8-13,15-16,18H,4-7,14H2,1-3H3,(H,29,30,31)/b22-15+