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

Systemtic Name: N1-[4-[butyl-(2-methylpropylsulfonylamino)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-5-sulfamoyl-benzene-1,3-dicarboxamide Openeye Name: N1-[1-benzyl-3-[butyl-(isobutylsulfonylamino)amino]-2-hydroxy-propyl]-N3,N3-dipropyl-5-sulfamoyl-benzene-1,3-dicarboxamide CAS Name: N1-[4-[butyl-(2-methylpropylsulfonylamino)amino]-3-hydroxy-1-phenylbutan-2-yl]-N3,N3-dipropyl-5-sulfamoylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[4-[butyl-(2-methylpropylsulfonylamino)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-N,3-N-dipropyl-5-sulfamoylbenzene-1,3-dicarboxamide Traditional Name: N-[1-benzyl-3-[butyl-(isobutylsulfonylamino)amino]-2-hydroxy-propyl]-N',N'-dipropyl-5-sulfamoyl-isophthalamide Formula: C32H51N5O7S2 MolecularWeight: 681.90664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)S(=O)(=O)N)C(=O)N(CCC)CCC)O)NS(=O)(=O)CC(C)C

Isomeric SMILES

CCCCN(CC(C(CC1=CC=CC=C1)NC(=O)C2=CC(=CC(=C2)S(=O)(=O)N)C(=O)N(CCC)CCC)O)NS(=O)(=O)CC(C)C

InChI

InChI=1S/C32H51N5O7S2/c1-6-9-17-37(35-45(41,42)23-24(4)5)22-30(38)29(18-25-13-11-10-12-14-25)34-31(39)26-19-27(21-28(20-26)46(33,43)44)32(40)36(15-7-2)16-8-3/h10-14,19-21,24,29-30,35,38H,6-9,15-18,22-23H2,1-5H3,(H,34,39)(H2,33,43,44)