5-nitro-N-(pyridin-3-ylmethyl)-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-(pyridin-3-ylmethyl)-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine Openeye Name: 5-nitro-N-(3-pyridylmethyl)-6-(8-quinolylsulfanyl)pyrimidin-4-amine CAS Name: 5-nitro-N-(3-pyridinylmethyl)-6-(8-quinolinylthio)-4-pyrimidinamine IUPAC Name: 5-nitro-N-(pyridin-3-ylmethyl)-6-quinolin-8-ylsulfanylpyrimidin-4-amine Traditional Name: [5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]-(3-pyridylmethyl)amine Formula: C19H14N6O2S MolecularWeight: 390.41846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC3=NC=NC(=C3[N+](=O)[O-])NCC4=CN=CC=C4)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SC3=NC=NC(=C3[N+](=O)[O-])NCC4=CN=CC=C4)N=CC=C2

InChI

InChI=1S/C19H14N6O2S/c26-25(27)17-18(22-11-13-4-2-8-20-10-13)23-12-24-19(17)28-15-7-1-5-14-6-3-9-21-16(14)15/h1-10,12H,11H2,(H,22,23,24)