5-methyl-4-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-(1-prop-2-ynylindol-3-yl)methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-methyl-4-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-(1-prop-2-ynylindol-3-yl)methyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(1-prop-2-ynylindol-3-yl)methyl]-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(1-prop-2-ynyl-3-indolyl)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(1-prop-2-ynylindol-3-yl)methyl]-1,2-dihydropyrazol-3-one Traditional Name: 4-[(3-keto-5-methyl-3-pyrazolin-4-yl)-(1-propargylindol-3-yl)methyl]-5-methyl-3-pyrazolin-3-one Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C(C2=CN(C3=CC=CC=C32)CC#C)C4=C(NNC4=O)C

Isomeric SMILES

CC1=C(C(=O)NN1)C(C2=CN(C3=CC=CC=C32)CC#C)C4=C(NNC4=O)C

InChI

InChI=1S/C20H19N5O2/c1-4-9-25-10-14(13-7-5-6-8-15(13)25)18(16-11(2)21-23-19(16)26)17-12(3)22-24-20(17)27/h1,5-8,10,18H,9H2,2-3H3,(H2,21,23,26)(H2,22,24,27)