(E)-N-(2-cyclopentylsulfanylphenyl)-3-(1-methylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(2-cyclopentylsulfanylphenyl)-3-(1-methylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(2-cyclopentylsulfanylphenyl)-3-(1-methylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[2-(cyclopentylthio)phenyl]-3-(1-methyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-(2-cyclopentylsulfanylphenyl)-3-(1-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[2-(cyclopentylthio)phenyl]-3-(1-methylpyrazol-4-yl)acrylamide Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)NC2=CC=CC=C2SC3CCCC3

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)NC2=CC=CC=C2SC3CCCC3

InChI

InChI=1S/C18H21N3OS/c1-21-13-14(12-19-21)10-11-18(22)20-16-8-4-5-9-17(16)23-15-6-2-3-7-15/h4-5,8-13,15H,2-3,6-7H2,1H3,(H,20,22)/b11-10+