5-methyl-4-[[2-[(pentylamino)methyl]-1H-indol-3-yl]methyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-methyl-4-[[2-[(pentylamino)methyl]-1H-indol-3-yl]methyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-methyl-4-[[2-[(pentylamino)methyl]-1H-indol-3-yl]methyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-methyl-4-[[2-[(pentylamino)methyl]-1H-indol-3-yl]methyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-methyl-4-[[2-[(pentylamino)methyl]-1H-indol-3-yl]methyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 4-[[2-[(amylamino)methyl]-1H-indol-3-yl]methyl]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=C(C2=CC=CC=C2N1)CC3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CCCCCNCC1=C(C2=CC=CC=C2N1)CC3C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H30N4O/c1-3-4-10-15-26-17-24-22(20-13-8-9-14-23(20)27-24)16-21-18(2)28-29(25(21)30)19-11-6-5-7-12-19/h5-9,11-14,21,26-27H,3-4,10,15-17H2,1-2H3