N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide

Systemtic Name: N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Openeye Name: 4-[(isopropylcarbamoylamino)methyl]-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]benzamide CAS Name: N-[3-(3-methyl-1-phenyl-4-pyrazolyl)propyl]-4-[[[oxo-(propan-2-ylamino)methyl]amino]methyl]benzamide IUPAC Name: N-[3-(3-methyl-1-phenylpyrazol-4-yl)propyl]-4-[(propan-2-ylcarbamoylamino)methyl]benzamide Traditional Name: 4-[(isopropylcarbamoylamino)methyl]-N-[3-(3-methyl-1-phenyl-pyrazol-4-yl)propyl]benzamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1CCCNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C=C1CCCNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C3=CC=CC=C3

InChI

InChI=1S/C25H31N5O2/c1-18(2)28-25(32)27-16-20-11-13-21(14-12-20)24(31)26-15-7-8-22-17-30(29-19(22)3)23-9-5-4-6-10-23/h4-6,9-14,17-18H,7-8,15-16H2,1-3H3,(H,26,31)(H2,27,28,32)