4-[[1-[3-(2-dimethylaminoethylamino)-2-oxidanyl-propyl]indol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[[1-[3-(2-dimethylaminoethylamino)-2-oxidanyl-propyl]indol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[[1-[3-(2-dimethylaminoethylamino)-2-hydroxy-propyl]indol-3-yl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[[1-[3-(2-dimethylaminoethylamino)-2-hydroxypropyl]-3-indolyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[[1-[3-(2-dimethylaminoethylamino)-2-hydroxypropyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[[1-[3-(2-dimethylaminoethylamino)-2-hydroxy-propyl]indol-3-yl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNCCN(C)C)O)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC(CNCCN(C)C)O)C4=CC=CC=C4

InChI

InChI=1S/C26H31N5O2/c1-19-24(26(33)31(28-19)21-9-5-4-6-10-21)15-20-17-30(25-12-8-7-11-23(20)25)18-22(32)16-27-13-14-29(2)3/h4-12,15,17,22,27,32H,13-14,16,18H2,1-3H3