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

Systemtic Name: 2-methyl-N-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)quinolin-5-amine Openeye Name: 2-methyl-N-(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)quinolin-5-amine CAS Name: 2-methyl-N-[5-nitro-6-(phenylthio)-4-pyrimidinyl]-5-quinolinamine IUPAC Name: 2-methyl-N-(5-nitro-6-phenylsulfanylpyrimidin-4-yl)quinolin-5-amine Traditional Name: (2-methyl-5-quinolyl)-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C20H15N5O2S MolecularWeight: 389.4304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)SC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)NC3=C(C(=NC=N3)SC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O2S/c1-13-10-11-15-16(23-13)8-5-9-17(15)24-19-18(25(26)27)20(22-12-21-19)28-14-6-3-2-4-7-14/h2-12H,1H3,(H,21,22,24)