N-[4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-oxidanyl-4-phenylsulfanyl-butanamide hydrochloride

Systemtic Name: N-[4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-oxidanyl-4-phenylsulfanyl-butanamide hydrochloride Openeye Name: N-[1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-2-hydroxy-4-phenylsulfanyl-butanamide hydrochloride CAS Name: 2-hydroxy-N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-4-(phenylthio)butanamide hydrochloride IUPAC Name: 2-hydroxy-N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-4-phenylsulfanylbutanamide hydrochloride Traditional Name: N-[1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-2-hydroxy-4-(phenylthio)butyramide hydrochloride Formula: C28H35ClN2O4S MolecularWeight: 531.1065

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNCC(C(CC2=CC=CC=C2)NC(=O)C(CCSC3=CC=CC=C3)O)O.Cl

Isomeric SMILES

COC1=CC=CC(=C1)CNCC(C(CC2=CC=CC=C2)NC(=O)C(CCSC3=CC=CC=C3)O)O.Cl

InChI

InChI=1S/C28H34N2O4S.ClH/c1-34-23-12-8-11-22(17-23)19-29-20-27(32)25(18-21-9-4-2-5-10-21)30-28(33)26(31)15-16-35-24-13-6-3-7-14-24;/h2-14,17,25-27,29,31-32H,15-16,18-20H2,1H3,(H,30,33);1H