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

Systemtic Name: N-cyclohexyl-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-cyclohexyl-5-[2-(3-pyridyl)quinazolin-4-yl]sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-cyclohexyl-5-[[2-(3-pyridinyl)-4-quinazolinyl]thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-cyclohexyl-5-(2-pyridin-3-ylquinazolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: cyclohexyl-[5-[[2-(3-pyridyl)quinazolin-4-yl]thio]-1,3,4-thiadiazol-2-yl]amine Formula: C21H20N6S2 MolecularWeight: 420.5537

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NN=C(S2)SC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

C1CCC(CC1)NC2=NN=C(S2)SC3=NC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C21H20N6S2/c1-2-8-15(9-3-1)23-20-26-27-21(29-20)28-19-16-10-4-5-11-17(16)24-18(25-19)14-7-6-12-22-13-14/h4-7,10-13,15H,1-3,8-9H2,(H,23,26)