(4Z)-5-methyl-2-phenyl-4-[(1-prop-2-ynylindol-3-yl)methylidene]pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-2-phenyl-4-[(1-prop-2-ynylindol-3-yl)methylidene]pyrazol-3-one Openeye Name: (4Z)-5-methyl-2-phenyl-4-[(1-prop-2-ynylindol-3-yl)methylene]pyrazol-3-one CAS Name: (4Z)-5-methyl-2-phenyl-4-[(1-prop-2-ynyl-3-indolyl)methylidene]-3-pyrazolone IUPAC Name: (4Z)-5-methyl-2-phenyl-4-[(1-prop-2-ynylindol-3-yl)methylidene]pyrazol-3-one Traditional Name: (4Z)-5-methyl-2-phenyl-4-[(1-propargylindol-3-yl)methylene]-2-pyrazolin-3-one Formula: C22H17N3O MolecularWeight: 339.38988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CN(C3=CC=CC=C32)CC#C)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O/c1-3-13-24-15-17(19-11-7-8-12-21(19)24)14-20-16(2)23-25(22(20)26)18-9-5-4-6-10-18/h1,4-12,14-15H,13H2,2H3/b20-14-