(E)-N-[2-(5-bromanylthiophen-2-yl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[2-(5-bromanylthiophen-2-yl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[2-(5-bromo-2-thienyl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[2-(5-bromo-2-thiophenyl)ethyl]-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-[2-(5-bromothiophen-2-yl)ethyl]-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[2-(5-bromo-2-thienyl)ethyl]-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C18H16BrN3OS MolecularWeight: 402.30814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC(=O)NCCC3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C(=O)NCCC3=CC=C(S3)Br

InChI

InChI=1S/C18H16BrN3OS/c19-17-8-7-16(24-17)10-11-20-18(23)9-6-14-12-21-22(13-14)15-4-2-1-3-5-15/h1-9,12-13H,10-11H2,(H,20,23)/b9-6+