2-[(4-methylphenyl)sulfonylamino]-N-[5-[2-methylpropyl(thiophen-2-ylsulfonyl)amino]hexyl]-3-phenyl-propanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-N-[5-[2-methylpropyl(thiophen-2-ylsulfonyl)amino]hexyl]-3-phenyl-propanamide Openeye Name: N-[5-[isobutyl(2-thienylsulfonyl)amino]hexyl]-3-phenyl-2-(p-tolylsulfonylamino)propanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-[5-[2-methylpropyl(thiophen-2-ylsulfonyl)amino]hexyl]-3-phenylpropanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-N-[5-[2-methylpropyl(thiophen-2-ylsulfonyl)amino]hexyl]-3-phenylpropanamide Traditional Name: N-[5-[isobutyl(2-thienylsulfonyl)amino]hexyl]-3-phenyl-2-(tosylamino)propionamide Formula: C30H41N3O5S3 MolecularWeight: 619.85864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NCCCCC(C)N(CC(C)C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NCCCCC(C)N(CC(C)C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C30H41N3O5S3/c1-23(2)22-33(41(37,38)29-14-10-20-39-29)25(4)11-8-9-19-31-30(34)28(21-26-12-6-5-7-13-26)32-40(35,36)27-17-15-24(3)16-18-27/h5-7,10,12-18,20,23,25,28,32H,8-9,11,19,21-22H2,1-4H3,(H,31,34)