3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-ethynylphenyl)propanamide

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-ethynylphenyl)propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-ethynylphenyl)propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-(3-ethynylphenyl)propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-ethynylphenyl)propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-(3-ethynylphenyl)propionamide Formula: C23H20N4O MolecularWeight: 368.4311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4=CC=CC(=C4)C#C

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4=CC=CC(=C4)C#C

InChI

InChI=1S/C23H20N4O/c1-4-17-8-7-9-18(14-17)25-22(28)13-12-19-15(2)24-23-20-10-5-6-11-21(20)26-27(23)16(19)3/h1,5-11,14H,12-13H2,2-3H3,(H,25,28)