5-isoquinolin-5-ylsulfanyl-2-nitro-aniline

Systemtic Name: 5-isoquinolin-5-ylsulfanyl-2-nitro-aniline Openeye Name: 5-(5-isoquinolylsulfanyl)-2-nitro-aniline CAS Name: 5-(5-isoquinolinylthio)-2-nitroaniline IUPAC Name: 5-isoquinolin-5-ylsulfanyl-2-nitroaniline Traditional Name: [5-(5-isoquinolylthio)-2-nitro-phenyl]amine Formula: C15H11N3O2S MolecularWeight: 297.33174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)SC3=CC(=C(C=C3)[N+](=O)[O-])N

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)SC3=CC(=C(C=C3)[N+](=O)[O-])N

InChI

InChI=1S/C15H11N3O2S/c16-13-8-11(4-5-14(13)18(19)20)21-15-3-1-2-10-9-17-7-6-12(10)15/h1-9H,16H2