N-[3-[2-(7-chloranyl-6-methyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)propylsulfinamoyloxy]-4-(2-ethoxyethoxy)phenyl]-2-(2,4-dimethylphenoxy)propanamide

Systemtic Name: N-[3-[2-(7-chloranyl-6-methyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)propylsulfinamoyloxy]-4-(2-ethoxyethoxy)phenyl]-2-(2,4-dimethylphenoxy)propanamide Openeye Name: N-[3-[2-(7-chloro-6-methyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)propylsulfinamoyloxy]-4-(2-ethoxyethoxy)phenyl]-2-(2,4-dimethylphenoxy)propanamide CAS Name: N-[3-[2-(7-chloro-6-methyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)propylsulfinamoyloxy]-4-(2-ethoxyethoxy)phenyl]-2-(2,4-dimethylphenoxy)propanamide IUPAC Name: N-[3-[2-(7-chloro-6-methyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)propylsulfinamoyloxy]-4-(2-ethoxyethoxy)phenyl]-2-(2,4-dimethylphenoxy)propanamide Traditional Name: N-[3-[2-(7-chloro-6-methyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl)propylsulfinamoyloxy]-4-(2-ethoxyethoxy)phenyl]-2-(2,4-dimethylphenoxy)propionamide Formula: C29H37ClN6O6S MolecularWeight: 633.15868

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=C(C=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2)C)C)OS(=O)NCC(C)C3=NN4C(=N3)C(=C(N4)C)Cl

Isomeric SMILES

CCOCCOC1=C(C=C(C=C1)NC(=O)C(C)OC2=C(C=C(C=C2)C)C)OS(=O)NCC(C)C3=NN4C(=N3)C(=C(N4)C)Cl

InChI

InChI=1S/C29H37ClN6O6S/c1-7-39-12-13-40-24-11-9-22(32-29(37)21(6)41-23-10-8-17(2)14-18(23)3)15-25(24)42-43(38)31-16-19(4)27-33-28-26(30)20(5)34-36(28)35-27/h8-11,14-15,19,21,31,34H,7,12-13,16H2,1-6H3,(H,32,37)