N-[6-fluoranyl-2-(2-methylsulfonylphenoxy)quinazolin-4-yl]-3-methyl-1,2,4-thiadiazol-5-amine

Systemtic Name: N-[6-fluoranyl-2-(2-methylsulfonylphenoxy)quinazolin-4-yl]-3-methyl-1,2,4-thiadiazol-5-amine Openeye Name: N-[6-fluoro-2-(2-methylsulfonylphenoxy)quinazolin-4-yl]-3-methyl-1,2,4-thiadiazol-5-amine CAS Name: N-[6-fluoro-2-(2-methylsulfonylphenoxy)-4-quinazolinyl]-3-methyl-1,2,4-thiadiazol-5-amine IUPAC Name: N-[6-fluoro-2-(2-methylsulfonylphenoxy)quinazolin-4-yl]-3-methyl-1,2,4-thiadiazol-5-amine Traditional Name: [6-fluoro-2-(2-mesylphenoxy)quinazolin-4-yl]-(3-methyl-1,2,4-thiadiazol-5-yl)amine Formula: C18H14FN5O3S2 MolecularWeight: 431.463863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=N1)NC2=NC(=NC3=C2C=C(C=C3)F)OC4=CC=CC=C4S(=O)(=O)C

Isomeric SMILES

CC1=NSC(=N1)NC2=NC(=NC3=C2C=C(C=C3)F)OC4=CC=CC=C4S(=O)(=O)C

InChI

InChI=1S/C18H14FN5O3S2/c1-10-20-18(28-24-10)23-16-12-9-11(19)7-8-13(12)21-17(22-16)27-14-5-3-4-6-15(14)29(2,25)26/h3-9H,1-2H3,(H,20,21,22,23,24)