N-(4-chlorophenyl)-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(4-chlorophenyl)-5-nitro-6-quinolin-8-ylsulfanyl-pyrimidin-4-amine Openeye Name: N-(4-chlorophenyl)-5-nitro-6-(8-quinolylsulfanyl)pyrimidin-4-amine CAS Name: N-(4-chlorophenyl)-5-nitro-6-(8-quinolinylthio)-4-pyrimidinamine IUPAC Name: N-(4-chlorophenyl)-5-nitro-6-quinolin-8-ylsulfanylpyrimidin-4-amine Traditional Name: (4-chlorophenyl)-[5-nitro-6-(8-quinolylthio)pyrimidin-4-yl]amine Formula: C19H12ClN5O2S MolecularWeight: 409.84888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SC3=NC=NC(=C3[N+](=O)[O-])NC4=CC=C(C=C4)Cl)N=CC=C2

InChI

InChI=1S/C19H12ClN5O2S/c20-13-6-8-14(9-7-13)24-18-17(25(26)27)19(23-11-22-18)28-15-5-1-3-12-4-2-10-21-16(12)15/h1-11H,(H,22,23,24)