N-(3-methoxyphenyl)-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(3-methoxyphenyl)-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-(3-methoxyphenyl)-5-[2-(3-pyridyl)quinazolin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-(3-methoxyphenyl)-5-[[2-(3-pyridinyl)-4-quinazolinyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(3-methoxyphenyl)-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: (3-methoxyphenyl)-[5-[[2-(3-pyridyl)quinazolin-4-yl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C22H16N6OS2 MolecularWeight: 444.53204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NN=C(S2)SC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NN=C(S2)SC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C22H16N6OS2/c1-29-16-8-4-7-15(12-16)24-21-27-28-22(31-21)30-20-17-9-2-3-10-18(17)25-19(26-20)14-6-5-11-23-13-14/h2-13H,1H3,(H,24,27)