N-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]quinolin-5-amine

Systemtic Name: N-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]quinolin-5-amine Openeye Name: N-[6-(4-chlorophenyl)sulfanyl-5-nitro-pyrimidin-4-yl]quinolin-5-amine CAS Name: N-[6-[(4-chlorophenyl)thio]-5-nitro-4-pyrimidinyl]-5-quinolinamine IUPAC Name: N-[6-(4-chlorophenyl)sulfanyl-5-nitropyrimidin-4-yl]quinolin-5-amine Traditional Name: [6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]-(5-quinolyl)amine Formula: C19H12ClN5O2S MolecularWeight: 409.84888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)SC4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)SC4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

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