(E)-N-[5-(3,5-dimethylphenyl)thiophen-2-yl]-4-pyrrolidin-3-yl-but-2-enamide

Systemtic Name: (E)-N-[5-(3,5-dimethylphenyl)thiophen-2-yl]-4-pyrrolidin-3-yl-but-2-enamide Openeye Name: (E)-N-[5-(3,5-dimethylphenyl)-2-thienyl]-4-pyrrolidin-3-yl-but-2-enamide CAS Name: (E)-N-[5-(3,5-dimethylphenyl)-2-thiophenyl]-4-(3-pyrrolidinyl)-2-butenamide IUPAC Name: (E)-N-[5-(3,5-dimethylphenyl)thiophen-2-yl]-4-pyrrolidin-3-ylbut-2-enamide Traditional Name: (E)-N-[5-(3,5-dimethylphenyl)-2-thienyl]-4-pyrrolidin-3-yl-but-2-enamide Formula: C20H24N2OS MolecularWeight: 340.48236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC=C(S2)NC(=O)C=CCC3CCNC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC=C(S2)NC(=O)/C=C/CC3CCNC3)C

InChI

InChI=1S/C20H24N2OS/c1-14-10-15(2)12-17(11-14)18-6-7-20(24-18)22-19(23)5-3-4-16-8-9-21-13-16/h3,5-7,10-12,16,21H,4,8-9,13H2,1-2H3,(H,22,23)/b5-3+