(E)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-3-thiophen-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-3-thiophen-3-yl-prop-2-enamide Openeye Name: (E)-2-cyano-N-[4-[(1S)-1-methylpropyl]phenyl]-3-(3-thienyl)prop-2-enamide CAS Name: (E)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-3-(3-thiophenyl)-2-propenamide IUPAC Name: (E)-N-[4-[(2S)-butan-2-yl]phenyl]-2-cyano-3-thiophen-3-ylprop-2-enamide Traditional Name: (E)-2-cyano-N-[4-[(1S)-1-methylpropyl]phenyl]-3-(3-thienyl)acrylamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(=CC2=CSC=C2)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2OS/c1-3-13(2)15-4-6-17(7-5-15)20-18(21)16(11-19)10-14-8-9-22-12-14/h4-10,12-13H,3H2,1-2H3,(H,20,21)/b16-10+/t13-/m0/s1