N-[(2-methylpropan-2-yl)oxy]-2-[2-methylpropyl-(4-phenylphenyl)sulfonyl-amino]-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-[(2-methylpropan-2-yl)oxy]-2-[2-methylpropyl-(4-phenylphenyl)sulfonyl-amino]-4-(phenylmethylsulfanyl)butanamide Openeye Name: 4-benzylsulfanyl-N-tert-butoxy-2-[isobutyl-(4-phenylphenyl)sulfonyl-amino]butanamide CAS Name: N-[(2-methylpropan-2-yl)oxy]-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]-4-(phenylmethylthio)butanamide IUPAC Name: 4-benzylsulfanyl-N-[(2-methylpropan-2-yl)oxy]-2-[2-methylpropyl-(4-phenylphenyl)sulfonylamino]butanamide Traditional Name: 4-(benzylthio)-N-tert-butoxy-2-[isobutyl-(4-phenylphenyl)sulfonyl-amino]butyramide Formula: C31H40N2O4S2 MolecularWeight: 568.7903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(CCSCC1=CC=CC=C1)C(=O)NOC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CN(C(CCSCC1=CC=CC=C1)C(=O)NOC(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C31H40N2O4S2/c1-24(2)22-33(39(35,36)28-18-16-27(17-19-28)26-14-10-7-11-15-26)29(30(34)32-37-31(3,4)5)20-21-38-23-25-12-8-6-9-13-25/h6-19,24,29H,20-23H2,1-5H3,(H,32,34)