4-isoquinolin-5-ylsulfanyl-5-nitro-benzene-1,2-diamine

Systemtic Name: 4-isoquinolin-5-ylsulfanyl-5-nitro-benzene-1,2-diamine Openeye Name: 4-(5-isoquinolylsulfanyl)-5-nitro-benzene-1,2-diamine CAS Name: 4-(5-isoquinolinylthio)-5-nitrobenzene-1,2-diamine IUPAC Name: 4-isoquinolin-5-ylsulfanyl-5-nitrobenzene-1,2-diamine Traditional Name: [2-amino-4-(5-isoquinolylthio)-5-nitro-phenyl]amine Formula: C15H12N4O2S MolecularWeight: 312.34638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N4O2S/c16-11-6-13(19(20)21)15(7-12(11)17)22-14-3-1-2-9-8-18-5-4-10(9)14/h1-8H,16-17H2