N-butyl-N-methyl-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-butyl-N-methyl-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine Openeye Name: N-butyl-N-methyl-5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-amine CAS Name: N-butyl-N-methyl-5-nitro-6-(8-quinolinylthio)-4-pyrimidinamine IUPAC Name: N-butyl-N-methyl-5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-amine Traditional Name: butyl-methyl-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]amine Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C1=C(C(=NC=N1)SC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN(C)C1=C(C(=NC=N1)SC2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O2S/c1-3-4-11-22(2)17-16(23(24)25)18(21-12-20-17)26-14-9-5-7-13-8-6-10-19-15(13)14/h5-10,12H,3-4,11H2,1-2H3