N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)-2-methylpropyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)-2-methyl-propyl]-4-[(isopropylcarbamoylamino)methyl]benzamide Formula: C21H31N5O2 MolecularWeight: 385.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(C)CNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C

Isomeric SMILES

CC1=CC(=NN1CC(C)CNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C

InChI

InChI=1S/C21H31N5O2/c1-14(2)24-21(28)23-12-18-6-8-19(9-7-18)20(27)22-11-15(3)13-26-17(5)10-16(4)25-26/h6-10,14-15H,11-13H2,1-5H3,(H,22,27)(H2,23,24,28)