N-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-4-[3-(4-methylbenzenesulfonyl)-2-[(4-methylbenzenesulfonyl)methyl]propanoyl]benzamide

CAS: 1802908-01-5

Formula: C33H40N4O9S2

SMILES: CC1=CC=C(C=C1)S(=O)(=O)CC(CS(=O)(=O)C1=CC=C(C)C=C1)C(=O)C1=CC=C(C=C1)C(=O)NCCOCCOCCOCCN=[N+]=[N-]

IUPAC: N-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-4-[3-(4-methylbenzenesulfonyl)-2-[(4-methylbenzenesulfonyl)methyl]propanoyl]benzamide

InChI: InChI=1S/C33H40N4O9S2/c1-25-3-11-30(12-4-25)47(40,41)23-29(24-48(42,43)31-13-5-26(2)6-14-31)32(38)27-7-9-28(10-8-27)33(39)35-15-17-44-19-21-46-22-20-45-18-16-36-37-34/h3-14,29H,15-24H2,1-2H3,(H,35,39)

Composition: C (56.56%), H (5.75%), N (7.99%), O (20.55%), S (9.15%)

Molar Mass: 700.82

Atom Count: 88

Heavy Atom Count: 48