N-[(4-fluorophenyl)methyl]-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-[(4-fluorophenyl)methyl]-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-[(4-fluorophenyl)methyl]-5-[2-(3-pyridyl)quinazolin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-[(4-fluorophenyl)methyl]-5-[[2-(3-pyridinyl)-4-quinazolinyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-[(4-fluorophenyl)methyl]-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: (4-fluorobenzyl)-[5-[[2-(3-pyridyl)quinazolin-4-yl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C22H15FN6S2 MolecularWeight: 446.523103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CN=CC=C3)SC4=NN=C(S4)NCC5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CN=CC=C3)SC4=NN=C(S4)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C22H15FN6S2/c23-16-9-7-14(8-10-16)12-25-21-28-29-22(31-21)30-20-17-5-1-2-6-18(17)26-19(27-20)15-4-3-11-24-13-15/h1-11,13H,12H2,(H,25,28)