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

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(4-methylsulfanylphenyl)propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(4-methylsulfanylphenyl)propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-[4-(methylthio)phenyl]propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(4-methylsulfanylphenyl)propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-[4-(methylthio)phenyl]propionamide Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4OS/c1-14-18(12-13-21(27)24-16-8-10-17(28-3)11-9-16)15(2)26-22(23-14)19-6-4-5-7-20(19)25-26/h4-11H,12-13H2,1-3H3,(H,24,27)