3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)propionamide Formula: C25H27N5O4S MolecularWeight: 493.57798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4=C(C=CC(=C4)S(=O)(=O)N5CCCC5)O

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4=C(C=CC(=C4)S(=O)(=O)N5CCCC5)O

InChI

InChI=1S/C25H27N5O4S/c1-16-19(17(2)30-25(26-16)20-7-3-4-8-21(20)28-30)10-12-24(32)27-22-15-18(9-11-23(22)31)35(33,34)29-13-5-6-14-29/h3-4,7-9,11,15,31H,5-6,10,12-14H2,1-2H3,(H,27,32)