(E)-2-cyano-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-2-cyano-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-2-cyano-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-2-cyano-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-2-cyano-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-[(1S)-1-(2,5-dimethylphenyl)ethyl]-3-(2-thienyl)acrylamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)NC(=O)C(=CC2=CC=CS2)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@H](C)NC(=O)/C(=C/C2=CC=CS2)/C#N

InChI

InChI=1S/C18H18N2OS/c1-12-6-7-13(2)17(9-12)14(3)20-18(21)15(11-19)10-16-5-4-8-22-16/h4-10,14H,1-3H3,(H,20,21)/b15-10+/t14-/m0/s1