N-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)quinolin-8-amine

Systemtic Name: N-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)quinolin-8-amine Openeye Name: N-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)quinolin-8-amine CAS Name: N-[5-nitro-6-(phenylthio)-4-pyrimidinyl]-8-quinolinamine IUPAC Name: N-(5-nitro-6-phenylsulfanylpyrimidin-4-yl)quinolin-8-amine Traditional Name: [5-nitro-6-(phenylthio)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C19H13N5O2S MolecularWeight: 375.40382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C19H13N5O2S/c25-24(26)17-18(21-12-22-19(17)27-14-8-2-1-3-9-14)23-15-10-4-6-13-7-5-11-20-16(13)15/h1-12H,(H,21,22,23)