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

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-1-[4-(2-thenoyl)piperazino]propan-1-one Formula: C24H25N5O2S MolecularWeight: 447.5526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)N4CCN(CC4)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)N4CCN(CC4)C(=O)C5=CC=CS5

InChI

InChI=1S/C24H25N5O2S/c1-16-18(17(2)29-23(25-16)19-6-3-4-7-20(19)26-29)9-10-22(30)27-11-13-28(14-12-27)24(31)21-8-5-15-32-21/h3-8,15H,9-14H2,1-2H3