N1-[4-[ethyl-[(phenylmethyl)sulfonylamino]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-5-sulfamoyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[4-[ethyl-[(phenylmethyl)sulfonylamino]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-5-sulfamoyl-benzene-1,3-dicarboxamide Openeye Name: N1-[1-benzyl-3-[(benzylsulfonylamino)-ethyl-amino]-2-hydroxy-propyl]-N3,N3-dipropyl-5-sulfamoyl-benzene-1,3-dicarboxamide CAS Name: N1-[4-[ethyl-[(phenylmethyl)sulfonylamino]amino]-3-hydroxy-1-phenylbutan-2-yl]-N3,N3-dipropyl-5-sulfamoylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[4-[(benzylsulfonylamino)-ethylamino]-3-hydroxy-1-phenylbutan-2-yl]-3-N,3-N-dipropyl-5-sulfamoylbenzene-1,3-dicarboxamide Traditional Name: N-[1-benzyl-3-[(benzylsulfonylamino)-ethyl-amino]-2-hydroxy-propyl]-N',N'-dipropyl-5-sulfamoyl-isophthalamide Formula: C33H45N5O7S2 MolecularWeight: 687.8697

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CN(CC)NS(=O)(=O)CC3=CC=CC=C3)O)S(=O)(=O)N

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CN(CC)NS(=O)(=O)CC3=CC=CC=C3)O)S(=O)(=O)N

InChI

InChI=1S/C33H45N5O7S2/c1-4-17-37(18-5-2)33(41)28-20-27(21-29(22-28)47(34,44)45)32(40)35-30(19-25-13-9-7-10-14-25)31(39)23-38(6-3)36-46(42,43)24-26-15-11-8-12-16-26/h7-16,20-22,30-31,36,39H,4-6,17-19,23-24H2,1-3H3,(H,35,40)(H2,34,44,45)