2-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[2-(morpholinomethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[2-(4-morpholinylmethyl)-4-quinazolinyl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[2-(morpholin-4-ylmethyl)quinazolin-4-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[2-(morpholinomethyl)quinazolin-4-yl]thio]methyl]quinazolin-4-yl]amine Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC4=NC5=CC=CC=C5C(=N4)N

Isomeric SMILES

C1COCCN1CC2=NC3=CC=CC=C3C(=N2)SCC4=NC5=CC=CC=C5C(=N4)N

InChI

InChI=1S/C22H22N6OS/c23-21-15-5-1-3-7-17(15)25-20(26-21)14-30-22-16-6-2-4-8-18(16)24-19(27-22)13-28-9-11-29-12-10-28/h1-8H,9-14H2,(H2,23,25,26)