4-azanyl-N-pyren-1-yl-benzenesulfonamide

Systemtic Name: 4-azanyl-N-pyren-1-yl-benzenesulfonamide Openeye Name: 4-amino-N-pyren-1-yl-benzenesulfonamide CAS Name: 4-amino-N-(1-pyrenyl)benzenesulfonamide IUPAC Name: 4-amino-N-pyren-1-ylbenzenesulfonamide Traditional Name: 4-amino-N-pyren-1-yl-benzenesulfonamide Formula: C22H16N2O2S MolecularWeight: 372.43964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)NS(=O)(=O)C5=CC=C(C=C5)N

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)NS(=O)(=O)C5=CC=C(C=C5)N

InChI

InChI=1S/C22H16N2O2S/c23-17-8-10-18(11-9-17)27(25,26)24-20-13-7-16-5-4-14-2-1-3-15-6-12-19(20)22(16)21(14)15/h1-13,24H,23H2