N1-[4-[butyl-(propan-2-ylsulfonylamino)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide

Systemtic Name: N1-[4-[butyl-(propan-2-ylsulfonylamino)amino]-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide Openeye Name: N1-[1-benzyl-3-[butyl-(isopropylsulfonylamino)amino]-2-hydroxy-propyl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide CAS Name: N1-[4-[butyl-(propan-2-ylsulfonylamino)amino]-3-hydroxy-1-phenylbutan-2-yl]-N3,N3-dipropylbenzene-1,3,5-tricarboxamide IUPAC Name: 1-N-[4-[butyl-(propan-2-ylsulfonylamino)amino]-3-hydroxy-1-phenylbutan-2-yl]-3-N,3-N-dipropylbenzene-1,3,5-tricarboxamide Traditional Name: N1-[1-benzyl-3-[butyl-(isopropylsulfonylamino)amino]-2-hydroxy-propyl]-N3,N3-dipropyl-benzene-1,3,5-tricarboxamide Formula: C32H49N5O6S MolecularWeight: 631.82636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H49N5O6S/c1-6-9-17-37(35-44(42,43)23(4)5)22-29(38)28(18-24-13-11-10-12-14-24)34-31(40)26-19-25(30(33)39)20-27(21-26)32(41)36(15-7-2)16-8-3/h10-14,19-21,23,28-29,35,38H,6-9,15-18,22H2,1-5H3,(H2,33,39)(H,34,40)