N-(3-fluoranyl-4-methyl-phenyl)-2-[[2-[2-(2-methylbenzimidazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[[2-[2-(2-methylbenzimidazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]ethanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[[2-[2-(2-methylbenzimidazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[[2-[2-(2-methyl-1-benzimidazolyl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]acetamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[[2-[2-(2-methylbenzimidazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[[2-[2-(2-methylbenzimidazol-1-yl)ethyl]-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]thio]acetamide Formula: C28H24FN7OS MolecularWeight: 525.599863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C4=NC(=NN42)CCN5C(=NC6=CC=CC=C65)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C4=NC(=NN42)CCN5C(=NC6=CC=CC=C65)C)F

InChI

InChI=1S/C28H24FN7OS/c1-17-11-12-19(15-21(17)29)31-26(37)16-38-28-32-22-8-4-3-7-20(22)27-33-25(34-36(27)28)13-14-35-18(2)30-23-9-5-6-10-24(23)35/h3-12,15H,13-14,16H2,1-2H3,(H,31,37)