3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-1-(4-methylsulfonyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-(4-methylsulfonylpiperazin-1-yl)propan-1-one Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-1-(4-mesylpiperazino)propan-1-one Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)N4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)N4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C20H25N5O3S/c1-14-16(8-9-19(26)23-10-12-24(13-11-23)29(3,27)28)15(2)25-20(21-14)17-6-4-5-7-18(17)22-25/h4-7H,8-13H2,1-3H3