N-[5-[4-(oxidanylamino)butylsulfanyl]-2-(phenylmethyl)phenyl]-7-phenyl-heptanamide

Systemtic Name: N-[5-[4-(oxidanylamino)butylsulfanyl]-2-(phenylmethyl)phenyl]-7-phenyl-heptanamide Openeye Name: N-[2-benzyl-5-[4-(hydroxyamino)butylsulfanyl]phenyl]-7-phenyl-heptanamide CAS Name: N-[5-[4-(hydroxyamino)butylthio]-2-(phenylmethyl)phenyl]-7-phenylheptanamide IUPAC Name: N-[2-benzyl-5-[4-(hydroxyamino)butylsulfanyl]phenyl]-7-phenylheptanamide Traditional Name: N-[2-benzyl-5-[4-(hydroxyamino)butylthio]phenyl]-7-phenyl-enanthamide Formula: C30H38N2O2S MolecularWeight: 490.69992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC(=O)NC2=C(C=CC(=C2)SCCCCNO)CC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC(=O)NC2=C(C=CC(=C2)SCCCCNO)CC3=CC=CC=C3

InChI

InChI=1S/C30H38N2O2S/c33-30(18-10-2-1-5-13-25-14-6-3-7-15-25)32-29-24-28(35-22-12-11-21-31-34)20-19-27(29)23-26-16-8-4-9-17-26/h3-4,6-9,14-17,19-20,24,31,34H,1-2,5,10-13,18,21-23H2,(H,32,33)