3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(diethylamino)phenyl]propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(diethylamino)phenyl]propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(diethylamino)phenyl]propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-[4-(diethylamino)phenyl]propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-[4-(diethylamino)phenyl]propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-[4-(diethylamino)phenyl]propionamide Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)CCC2=C(N(N=C2C)CCC#N)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)CCC2=C(N(N=C2C)CCC#N)C

InChI

InChI=1S/C21H29N5O/c1-5-25(6-2)19-10-8-18(9-11-19)23-21(27)13-12-20-16(3)24-26(17(20)4)15-7-14-22/h8-11H,5-7,12-13,15H2,1-4H3,(H,23,27)