(2S)-N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide

Systemtic Name: (2S)-N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide Openeye Name: (2S)-N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanamide CAS Name: (2S)-N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide IUPAC Name: (2S)-N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide Traditional Name: (2S)-N-ethyl-N-(3-fluorobenzyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butyramide Formula: C21H27FN2O4S MolecularWeight: 422.513483

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=CC=C1)F)C(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCN(CC1=CC(=CC=C1)F)C(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H27FN2O4S/c1-5-24(14-16-7-6-8-17(22)13-16)21(25)20(15(2)3)23-29(26,27)19-11-9-18(28-4)10-12-19/h6-13,15,20,23H,5,14H2,1-4H3/t20-/m0/s1