N-[3-[5-[4-azanyl-2-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5-yl]-1,2,4-oxadiazol-3-yl]-4-fluoranyl-phenyl]-3-chloranyl-benzamide

Systemtic Name: N-[3-[5-[4-azanyl-2-[(3,4,5-trimethoxyphenyl)amino]-1,3-thiazol-5-yl]-1,2,4-oxadiazol-3-yl]-4-fluoranyl-phenyl]-3-chloranyl-benzamide Openeye Name: N-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)thiazol-5-yl]-1,2,4-oxadiazol-3-yl]-4-fluoro-phenyl]-3-chloro-benzamide CAS Name: N-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)-5-thiazolyl]-1,2,4-oxadiazol-3-yl]-4-fluorophenyl]-3-chlorobenzamide IUPAC Name: N-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)-1,3-thiazol-5-yl]-1,2,4-oxadiazol-3-yl]-4-fluorophenyl]-3-chlorobenzamide Traditional Name: N-[3-[5-[4-amino-2-(3,4,5-trimethoxyanilino)thiazol-5-yl]-1,2,4-oxadiazol-3-yl]-4-fluoro-phenyl]-3-chloro-benzamide Formula: C27H22ClFN6O5S MolecularWeight: 597.017183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC(=C(S2)C3=NC(=NO3)C4=C(C=CC(=C4)NC(=O)C5=CC(=CC=C5)Cl)F)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC(=C(S2)C3=NC(=NO3)C4=C(C=CC(=C4)NC(=O)C5=CC(=CC=C5)Cl)F)N

InChI

InChI=1S/C27H22ClFN6O5S/c1-37-19-11-16(12-20(38-2)21(19)39-3)32-27-33-23(30)22(41-27)26-34-24(35-40-26)17-10-15(7-8-18(17)29)31-25(36)13-5-4-6-14(28)9-13/h4-12H,30H2,1-3H3,(H,31,36)(H,32,33)