(E)-3-[1-cyclohexyl-5-(4-methylthiophen-2-yl)pyrazol-3-yl]prop-2-enoate

Systemtic Name: (E)-3-[1-cyclohexyl-5-(4-methylthiophen-2-yl)pyrazol-3-yl]prop-2-enoate Openeye Name: (E)-3-[1-cyclohexyl-5-(4-methyl-2-thienyl)pyrazol-3-yl]prop-2-enoate CAS Name: (E)-3-[1-cyclohexyl-5-(4-methyl-2-thiophenyl)-3-pyrazolyl]-2-propenoate IUPAC Name: (E)-3-[1-cyclohexyl-5-(4-methylthiophen-2-yl)pyrazol-3-yl]prop-2-enoate Traditional Name: (E)-3-[1-cyclohexyl-5-(4-methyl-2-thienyl)pyrazol-3-yl]acrylate Formula: C17H19N2O2S- MolecularWeight: 315.40996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=CC(=NN2C3CCCCC3)C=CC(=O)[O-]

Isomeric SMILES

CC1=CSC(=C1)C2=CC(=NN2C3CCCCC3)/C=C/C(=O)[O-]

InChI

InChI=1S/C17H20N2O2S/c1-12-9-16(22-11-12)15-10-13(7-8-17(20)21)18-19(15)14-5-3-2-4-6-14/h7-11,14H,2-6H2,1H3,(H,20,21)/p-1/b8-7+