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

Systemtic Name: N-[4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-phenylmethoxy-4-(phenylsulfonyl)butanamide hydrochloride Openeye Name: 4-(benzenesulfonyl)-N-[1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-2-benzyloxy-butanamide hydrochloride CAS Name: 4-(benzenesulfonyl)-N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-2-phenylmethoxybutanamide hydrochloride IUPAC Name: 4-(benzenesulfonyl)-N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-2-phenylmethoxybutanamide hydrochloride Traditional Name: 2-benzoxy-N-[1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-4-besyl-butyramide hydrochloride Formula: C35H41ClN2O6S MolecularWeight: 653.22784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNCC(C(CC2=CC=CC=C2)NC(=O)C(CCS(=O)(=O)C3=CC=CC=C3)OCC4=CC=CC=C4)O.Cl

Isomeric SMILES

COC1=CC=CC(=C1)CNCC(C(CC2=CC=CC=C2)NC(=O)C(CCS(=O)(=O)C3=CC=CC=C3)OCC4=CC=CC=C4)O.Cl

InChI

InChI=1S/C35H40N2O6S.ClH/c1-42-30-17-11-16-29(22-30)24-36-25-33(38)32(23-27-12-5-2-6-13-27)37-35(39)34(43-26-28-14-7-3-8-15-28)20-21-44(40,41)31-18-9-4-10-19-31;/h2-19,22,32-34,36,38H,20-21,23-26H2,1H3,(H,37,39);1H