N-(4-ethyl-2,5-dimethyl-pyrazol-3-yl)-5-[1-[(E)-pent-3-enoyl]pyrrolidin-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(4-ethyl-2,5-dimethyl-pyrazol-3-yl)-5-[1-[(E)-pent-3-enoyl]pyrrolidin-2-yl]thiophene-2-carboxamide Openeye Name: N-(4-ethyl-2,5-dimethyl-pyrazol-3-yl)-5-[1-[(E)-pent-3-enoyl]pyrrolidin-2-yl]thiophene-2-carboxamide CAS Name: N-(4-ethyl-2,5-dimethyl-3-pyrazolyl)-5-[1-[(E)-1-oxopent-3-enyl]-2-pyrrolidinyl]-2-thiophenecarboxamide IUPAC Name: N-(4-ethyl-2,5-dimethylpyrazol-3-yl)-5-[1-[(E)-pent-3-enoyl]pyrrolidin-2-yl]thiophene-2-carboxamide Traditional Name: N-(4-ethyl-2,5-dimethyl-pyrazol-3-yl)-5-[1-[(E)-pent-3-enoyl]pyrrolidin-2-yl]thiophene-2-carboxamide Formula: C21H28N4O2S MolecularWeight: 400.53762

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(N=C1C)C)NC(=O)C2=CC=C(S2)C3CCCN3C(=O)CC=CC

Isomeric SMILES

CCC1=C(N(N=C1C)C)NC(=O)C2=CC=C(S2)C3CCCN3C(=O)C/C=C/C

InChI

InChI=1S/C21H28N4O2S/c1-5-7-10-19(26)25-13-8-9-16(25)17-11-12-18(28-17)21(27)22-20-15(6-2)14(3)23-24(20)4/h5,7,11-12,16H,6,8-10,13H2,1-4H3,(H,22,27)/b7-5+