(E)-2-cyano-N-(3-morpholin-4-ylpropyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-morpholin-4-ylpropyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-morpholinopropyl)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-[3-(4-morpholinyl)propyl]-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-morpholin-4-ylpropyl)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-morpholinopropyl)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylamide Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1COCCN1CCCNC(=O)/C(=C/C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)/C#N

InChI

InChI=1S/C24H25N5O2S/c25-17-19(24(30)26-9-5-10-28-11-13-31-14-12-28)16-20-18-29(21-6-2-1-3-7-21)27-23(20)22-8-4-15-32-22/h1-4,6-8,15-16,18H,5,9-14H2,(H,26,30)/b19-16+