N-[4-[(3,6-diazidoacridin-9-yl)amino]-2-methoxy-phenyl]methanesulfonamide

Systemtic Name: N-[4-[(3,6-diazidoacridin-9-yl)amino]-2-methoxy-phenyl]methanesulfonamide Openeye Name: N-[4-[(3,6-diazidoacridin-9-yl)amino]-2-methoxy-phenyl]methanesulfonamide CAS Name: N-[4-[(3,6-diazido-9-acridinyl)amino]-2-methoxyphenyl]methanesulfonamide IUPAC Name: N-[4-[(3,6-diazidoacridin-9-yl)amino]-2-methoxyphenyl]methanesulfonamide Traditional Name: N-[4-[(3,6-diazidoacridin-9-yl)amino]-2-methoxy-phenyl]methanesulfonamide Formula: C21H17N9O3S MolecularWeight: 475.48318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)N=[N+]=[N-])N=[N+]=[N-])NS(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC4=C2C=CC(=C4)N=[N+]=[N-])N=[N+]=[N-])NS(=O)(=O)C

InChI

InChI=1S/C21H17N9O3S/c1-33-20-11-12(5-8-17(20)28-34(2,31)32)24-21-15-6-3-13(26-29-22)9-18(15)25-19-10-14(27-30-23)4-7-16(19)21/h3-11,28H,1-2H3,(H,24,25)