tert-butyl N-[2-methoxy-5-[3-(phenylsulfonylamino)propanoylamino]phenyl]carbamate

Systemtic Name: tert-butyl N-[2-methoxy-5-[3-(phenylsulfonylamino)propanoylamino]phenyl]carbamate Openeye Name: tert-butyl N-[5-[3-(benzenesulfonamido)propanoylamino]-2-methoxy-phenyl]carbamate CAS Name: N-[5-[[3-(benzenesulfonamido)-1-oxopropyl]amino]-2-methoxyphenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-[3-(benzenesulfonamido)propanoylamino]-2-methoxyphenyl]carbamate Traditional Name: N-[5-[3-(benzenesulfonamido)propanoylamino]-2-methoxy-phenyl]carbamic acid tert-butyl ester Formula: C21H27N3O6S MolecularWeight: 449.52058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)CCNS(=O)(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)CCNS(=O)(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C21H27N3O6S/c1-21(2,3)30-20(26)24-17-14-15(10-11-18(17)29-4)23-19(25)12-13-22-31(27,28)16-8-6-5-7-9-16/h5-11,14,22H,12-13H2,1-4H3,(H,23,25)(H,24,26)