2-[[3-[5-[4-azanyl-2-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]amino]-5-methyl-3H-1,3-thiazole-2-carboxylic acid

Systemtic Name: 2-[[3-[5-[4-azanyl-2-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]amino]-5-methyl-3H-1,3-thiazole-2-carboxylic acid Openeye Name: 2-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)thiazol-5-yl]-1,2,4-oxadiazol-3-yl]anilino]-5-methyl-3H-thiazole-2-carboxylic acid CAS Name: 2-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)-5-thiazolyl]-1,2,4-oxadiazol-3-yl]anilino]-5-methyl-3H-thiazole-2-carboxylic acid IUPAC Name: 2-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)-1,3-thiazol-5-yl]-1,2,4-oxadiazol-3-yl]anilino]-5-methyl-3H-1,3-thiazole-2-carboxylic acid Traditional Name: 2-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)thiazol-5-yl]-1,2,4-oxadiazol-3-yl]anilino]-5-methyl-4-thiazoline-2-carboxylic acid Formula: C25H25N7O6S2 MolecularWeight: 583.6393

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(S1)(C(=O)O)NC2=CC=CC(=C2)C3=NOC(=N3)C4=C(N=C(S4)NC5=CC(=C(C(=C5)OC)OC)OC)N

Isomeric SMILES

CC1=CNC(S1)(C(=O)O)NC2=CC=CC(=C2)C3=NOC(=N3)C4=C(N=C(S4)NC5=CC(=C(C(=C5)OC)OC)OC)N

InChI

InChI=1S/C25H25N7O6S2/c1-12-11-27-25(40-12,23(33)34)31-14-7-5-6-13(8-14)21-30-22(38-32-21)19-20(26)29-24(39-19)28-15-9-16(35-2)18(37-4)17(10-15)36-3/h5-11,27,31H,26H2,1-4H3,(H,28,29)(H,33,34)