N-(2-morpholin-4-ylethyl)-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(2-morpholin-4-ylethyl)-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine Openeye Name: N-(2-morpholinoethyl)-5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-amine CAS Name: N-[2-(4-morpholinyl)ethyl]-5-nitro-6-(8-quinolinylthio)-4-pyrimidinamine IUPAC Name: N-(2-morpholin-4-ylethyl)-5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-amine Traditional Name: 2-morpholinoethyl-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]amine Formula: C19H20N6O3S MolecularWeight: 412.4655

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCNC2=C(C(=NC=N2)SC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O3S/c26-25(27)17-18(21-7-8-24-9-11-28-12-10-24)22-13-23-19(17)29-15-5-1-3-14-4-2-6-20-16(14)15/h1-6,13H,7-12H2,(H,21,22,23)