3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-methyl-5-nitro-phenyl)propanamide

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCC2=C(N3C(=C4C=CC=CC4=N3)N=C2C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCC2=C(N3C(=C4C=CC=CC4=N3)N=C2C)C

InChI

InChI=1S/C22H21N5O3/c1-13-8-9-16(27(29)30)12-20(13)24-21(28)11-10-17-14(2)23-22-18-6-4-5-7-19(18)25-26(22)15(17)3/h4-9,12H,10-11H2,1-3H3,(H,24,28)