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

Systemtic Name: N-[4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-2-(3-methylbutylsulfonylamino)-4-methylsulfonyl-butanamide hydrochloride Openeye Name: N-[1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-2-(isopentylsulfonylamino)-4-methylsulfonyl-butanamide hydrochloride CAS Name: N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-2-(3-methylbutylsulfonylamino)-4-methylsulfonylbutanamide hydrochloride IUPAC Name: N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-2-(3-methylbutylsulfonylamino)-4-methylsulfonylbutanamide hydrochloride Traditional Name: N-[1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-2-(isoamylsulfonylamino)-4-mesyl-butyramide hydrochloride Formula: C28H44ClN3O7S2 MolecularWeight: 634.24786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCS(=O)(=O)NC(CCS(=O)(=O)C)C(=O)NC(CC1=CC=CC=C1)C(CNCC2=CC(=CC=C2)OC)O.Cl

Isomeric SMILES

CC(C)CCS(=O)(=O)NC(CCS(=O)(=O)C)C(=O)NC(CC1=CC=CC=C1)C(CNCC2=CC(=CC=C2)OC)O.Cl

InChI

InChI=1S/C28H43N3O7S2.ClH/c1-21(2)13-16-40(36,37)31-25(14-15-39(4,34)35)28(33)30-26(18-22-9-6-5-7-10-22)27(32)20-29-19-23-11-8-12-24(17-23)38-3;/h5-12,17,21,25-27,29,31-32H,13-16,18-20H2,1-4H3,(H,30,33);1H