N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-5-ethyl-4-methyl-2-thiophenecarboxamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-ethyl-4-methylthiophene-2-carboxamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide Formula: C21H22FN5OS MolecularWeight: 411.495683

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCC1=C(C=C(S1)C(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H22FN5OS/c1-3-18-13(2)11-19(29-18)21(28)25-10-4-5-17-16(12-23)20(24)27(26-17)15-8-6-14(22)7-9-15/h6-9,11H,3-5,10,24H2,1-2H3,(H,25,28)