methyl 6-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]hexanoate

Systemtic Name: methyl 6-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]hexanoate Openeye Name: methyl 6-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]hexanoate CAS Name: 6-[[3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-1-oxopropyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]hexanoate Traditional Name: 6-[3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)propanoylamino]hexanoic acid methyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C22H28N4O3/c1-15-17(12-13-20(27)23-14-8-4-5-11-21(28)29-3)16(2)26-22(24-15)18-9-6-7-10-19(18)25-26/h6-7,9-10H,4-5,8,11-14H2,1-3H3,(H,23,27)