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

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-5-ethyl-4-methyl-2-thiophenecarboxamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-5-ethyl-4-methylthiophene-2-carboxamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-5-ethyl-4-methyl-thiophene-2-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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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=CC=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5OS/c1-3-18-14(2)12-19(28-18)21(27)24-11-7-10-17-16(13-22)20(23)26(25-17)15-8-5-4-6-9-15/h4-6,8-9,12H,3,7,10-11,23H2,1-2H3,(H,24,27)