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

Systemtic Name: 5-methyl-4-[(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)-(2-methyl-1-prop-2-enyl-indol-3-yl)methyl]-1,2-dihydropyrazol-3-one Openeye Name: 4-[(1-allyl-2-methyl-indol-3-yl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(2-methyl-1-prop-2-enyl-3-indolyl)methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-[(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)-(2-methyl-1-prop-2-enylindol-3-yl)methyl]-1,2-dihydropyrazol-3-one Traditional Name: 4-[(1-allyl-2-methyl-indol-3-yl)-(3-keto-5-methyl-3-pyrazolin-4-yl)methyl]-5-methyl-3-pyrazolin-3-one Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C(C2=C(NNC2=O)C)C3=C(N(C4=CC=CC=C43)CC=C)C

Isomeric SMILES

CC1=C(C(=O)NN1)C(C2=C(NNC2=O)C)C3=C(N(C4=CC=CC=C43)CC=C)C

InChI

InChI=1S/C21H23N5O2/c1-5-10-26-13(4)18(14-8-6-7-9-15(14)26)19(16-11(2)22-24-20(16)27)17-12(3)23-25-21(17)28/h5-9,19H,1,10H2,2-4H3,(H2,22,24,27)(H2,23,25,28)