4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]benzamide

Systemtic Name: 4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]benzamide Openeye Name: 4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]benzamide CAS Name: 4-[[3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanoylamino]benzamide Traditional Name: 4-[3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)propanoylamino]benzamide Formula: C22H21N5O2 MolecularWeight: 387.43444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N5O2/c1-13-17(11-12-20(28)25-16-9-7-15(8-10-16)21(23)29)14(2)27-22(24-13)18-5-3-4-6-19(18)26-27/h3-10H,11-12H2,1-2H3,(H2,23,29)(H,25,28)