1-[(5-butyl-2-methyl-6,7-dihydropyrazolo[3,4-e][1,2]thiazin-3-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea

Systemtic Name: 1-[(5-butyl-2-methyl-6,7-dihydropyrazolo[3,4-e][1,2]thiazin-3-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Openeye Name: 1-[(5-butyl-2-methyl-6,7-dihydropyrazolo[3,4-e]thiazin-3-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-[(5-butyl-2-methyl-6,7-dihydropyrazolo[3,4-e]thiazin-3-yl)sulfonyl]-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-[(5-butyl-2-methyl-6,7-dihydropyrazolo[3,4-e]thiazin-3-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-[(5-butyl-2-methyl-6,7-dihydropyrazolo[3,4-e]thiazin-3-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Formula: C17H25N7O5S2 MolecularWeight: 471.5543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=NN(C(=C2S1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC)C

Isomeric SMILES

CCCCN1CCC2=NN(C(=C2S1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC)C

InChI

InChI=1S/C17H25N7O5S2/c1-5-6-8-24-9-7-11-14(30-24)15(23(2)21-11)31(26,27)22-17(25)20-16-18-12(28-3)10-13(19-16)29-4/h10H,5-9H2,1-4H3,(H2,18,19,20,22,25)