(2S)-2-{4-[(1E)-2-[4-(dimethylamino)phenyl]diazen-1-yl]benzenesulfonamido}-4-methylpentanoic acid

CAS: 89131-12-4

Formula: C20H26N4O4S

SMILES: CC(C)C[C@H](NS(=O)(=O)C1=CC=C(C=C1)N=NC1=CC=C(C=C1)N(C)C)C(O)=O

IUPAC: (2S)-2-{4-[(1E)-2-[4-(dimethylamino)phenyl]diazen-1-yl]benzenesulfonamido}-4-methylpentanoic acid

InChI: InChI=1S/C20H26N4O4S/c1-14(2)13-19(20(25)26)23-29(27,28)18-11-7-16(8-12-18)22-21-15-5-9-17(10-6-15)24(3)4/h5-12,14,19,23H,13H2,1-4H3,(H,25,26)/b22-21+/t19-/m0/s1

Composition: C (57.40%), H (6.26%), N (13.39%), O (15.29%), S (7.66%)

Molar Mass: 418.51

Atom Count: 55

Heavy Atom Count: 29