(E)-2-(2,6-dimethylphenyl)sulfanyl-N-methyl-3-phenethyloxy-N-pyridin-2-yl-prop-2-enamide

Systemtic Name: (E)-2-(2,6-dimethylphenyl)sulfanyl-N-methyl-3-phenethyloxy-N-pyridin-2-yl-prop-2-enamide Openeye Name: (E)-2-(2,6-dimethylphenyl)sulfanyl-N-methyl-3-phenethyloxy-N-(2-pyridyl)prop-2-enamide CAS Name: (E)-2-[(2,6-dimethylphenyl)thio]-N-methyl-3-phenethyloxy-N-(2-pyridinyl)-2-propenamide IUPAC Name: (E)-2-(2,6-dimethylphenyl)sulfanyl-N-methyl-3-phenethyloxy-N-pyridin-2-ylprop-2-enamide Traditional Name: (E)-2-[(2,6-dimethylphenyl)thio]-N-methyl-3-phenethyloxy-N-(2-pyridyl)acrylamide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)SC(=COCCC2=CC=CC=C2)C(=O)N(C)C3=CC=CC=N3

Isomeric SMILES

CC1=C(C(=CC=C1)C)S/C(=C/OCCC2=CC=CC=C2)/C(=O)N(C)C3=CC=CC=N3

InChI

InChI=1S/C25H26N2O2S/c1-19-10-9-11-20(2)24(19)30-22(18-29-17-15-21-12-5-4-6-13-21)25(28)27(3)23-14-7-8-16-26-23/h4-14,16,18H,15,17H2,1-3H3/b22-18+