3-azanyl-N-(cyclopentylmethyl)-N-[2-oxidanyl-3-[phenylcarbonyl-[(phenylmethyl)amino]amino]propyl]benzenesulfonamide

Systemtic Name: 3-azanyl-N-(cyclopentylmethyl)-N-[2-oxidanyl-3-[phenylcarbonyl-[(phenylmethyl)amino]amino]propyl]benzenesulfonamide Openeye Name: 3-amino-N-[3-[benzoyl-(benzylamino)amino]-2-hydroxy-propyl]-N-(cyclopentylmethyl)benzenesulfonamide CAS Name: 3-amino-N-[3-[benzoyl-[(phenylmethyl)amino]amino]-2-hydroxypropyl]-N-(cyclopentylmethyl)benzenesulfonamide IUPAC Name: 3-amino-N-[3-[benzoyl-(benzylamino)amino]-2-hydroxypropyl]-N-(cyclopentylmethyl)benzenesulfonamide Traditional Name: 3-amino-N-[3-[benzoyl-(benzylamino)amino]-2-hydroxy-propyl]-N-(cyclopentylmethyl)benzenesulfonamide Formula: C29H36N4O4S MolecularWeight: 536.68554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN(CC(CN(C(=O)C2=CC=CC=C2)NCC3=CC=CC=C3)O)S(=O)(=O)C4=CC=CC(=C4)N

Isomeric SMILES

C1CCC(C1)CN(CC(CN(C(=O)C2=CC=CC=C2)NCC3=CC=CC=C3)O)S(=O)(=O)C4=CC=CC(=C4)N

InChI

InChI=1S/C29H36N4O4S/c30-26-16-9-17-28(18-26)38(36,37)32(20-24-12-7-8-13-24)21-27(34)22-33(29(35)25-14-5-2-6-15-25)31-19-23-10-3-1-4-11-23/h1-6,9-11,14-18,24,27,31,34H,7-8,12-13,19-22,30H2