tert-butyl N-[2-[isoquinolin-5-ylsulfonyl-[2-(phenylsulfonyl)ethyl]amino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[isoquinolin-5-ylsulfonyl-[2-(phenylsulfonyl)ethyl]amino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[2-(benzenesulfonyl)ethyl-(5-isoquinolylsulfonyl)amino]ethyl]carbamate CAS Name: N-[2-[2-(benzenesulfonyl)ethyl-(5-isoquinolinylsulfonyl)amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[2-(benzenesulfonyl)ethyl-isoquinolin-5-ylsulfonylamino]ethyl]carbamate Traditional Name: N-[2-[2-besylethyl(5-isoquinolylsulfonyl)amino]ethyl]carbamic acid tert-butyl ester Formula: C24H29N3O6S2 MolecularWeight: 519.63356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCN(CCS(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC(C)(C)OC(=O)NCCN(CCS(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C24H29N3O6S2/c1-24(2,3)33-23(28)26-14-15-27(16-17-34(29,30)20-9-5-4-6-10-20)35(31,32)22-11-7-8-19-18-25-13-12-21(19)22/h4-13,18H,14-17H2,1-3H3,(H,26,28)