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

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-[(5-sulfamoylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-[(5-sulfamoyl-2-thienyl)methyl]propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-[(5-sulfamoyl-2-thiophenyl)methyl]propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-[(5-sulfamoylthiophen-2-yl)methyl]propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-[(5-sulfamoyl-2-thienyl)methyl]propionamide Formula: C20H21N5O3S2 MolecularWeight: 443.54244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NCC4=CC=C(S4)S(=O)(=O)N

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NCC4=CC=C(S4)S(=O)(=O)N

InChI

InChI=1S/C20H21N5O3S2/c1-12-15(13(2)25-20(23-12)16-5-3-4-6-17(16)24-25)8-9-18(26)22-11-14-7-10-19(29-14)30(21,27)28/h3-7,10H,8-9,11H2,1-2H3,(H,22,26)(H2,21,27,28)