4-[[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl-methyl-amino]methyl]-N-cyclopropyl-benzamide

Systemtic Name: 4-[[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl-methyl-amino]methyl]-N-cyclopropyl-benzamide Openeye Name: 4-[[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl-methyl-amino]methyl]-N-cyclopropyl-benzamide CAS Name: 4-[[[3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-1-oxopropyl]-methylamino]methyl]-N-cyclopropylbenzamide IUPAC Name: 4-[[3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]propanoyl-methylamino]methyl]-N-cyclopropylbenzamide Traditional Name: 4-[[3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]propanoyl-methyl-amino]methyl]-N-cyclopropyl-benzamide Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC3CC3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC3CC3

InChI

InChI=1S/C23H29N5O2/c1-16-21(17(2)28(26-16)14-4-13-24)11-12-22(29)27(3)15-18-5-7-19(8-6-18)23(30)25-20-9-10-20/h5-8,20H,4,9-12,14-15H2,1-3H3,(H,25,30)