(2S)-N-[(3,5-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide

Systemtic Name: (2S)-N-[(3,5-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide Openeye Name: (2S)-N-[(3,5-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide CAS Name: (2S)-N-[(3,5-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide IUPAC Name: (2S)-N-[(3,5-dimethoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide Traditional Name: (2S)-N-(3,5-dimethoxybenzyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butyramide Formula: C21H28N2O6S MolecularWeight: 436.52182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC(=CC(=C1)OC)OC)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC(=CC(=C1)OC)OC)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H28N2O6S/c1-14(2)20(23-30(25,26)19-8-6-16(27-3)7-9-19)21(24)22-13-15-10-17(28-4)12-18(11-15)29-5/h6-12,14,20,23H,13H2,1-5H3,(H,22,24)/t20-/m0/s1