(E)-3-(4-bromanylthiophen-2-yl)-2-cyano-N-(3-methoxypropyl)prop-2-enamide

Systemtic Name: (E)-3-(4-bromanylthiophen-2-yl)-2-cyano-N-(3-methoxypropyl)prop-2-enamide Openeye Name: (E)-3-(4-bromo-2-thienyl)-2-cyano-N-(3-methoxypropyl)prop-2-enamide CAS Name: (E)-3-(4-bromo-2-thiophenyl)-2-cyano-N-(3-methoxypropyl)-2-propenamide IUPAC Name: (E)-3-(4-bromothiophen-2-yl)-2-cyano-N-(3-methoxypropyl)prop-2-enamide Traditional Name: (E)-3-(4-bromo-2-thienyl)-2-cyano-N-(3-methoxypropyl)acrylamide Formula: C12H13BrN2O2S MolecularWeight: 329.21282

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C(=CC1=CC(=CS1)Br)C#N

Isomeric SMILES

COCCCNC(=O)/C(=C/C1=CC(=CS1)Br)/C#N

InChI

InChI=1S/C12H13BrN2O2S/c1-17-4-2-3-15-12(16)9(7-14)5-11-6-10(13)8-18-11/h5-6,8H,2-4H2,1H3,(H,15,16)/b9-5+