(2S)-N-[(2S)-butan-2-yl]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanamide

Systemtic Name: (2S)-N-[(2S)-butan-2-yl]-2-[methylsulfonyl-(4-phenoxyphenyl)amino]propanamide Openeye Name: (2S)-N-[(1S)-1-methylpropyl]-2-(N-methylsulfonyl-4-phenoxy-anilino)propanamide CAS Name: (2S)-N-[(2S)-butan-2-yl]-2-(N-methylsulfonyl-4-phenoxyanilino)propanamide IUPAC Name: (2S)-N-[(2S)-butan-2-yl]-2-(N-methylsulfonyl-4-phenoxyanilino)propanamide Traditional Name: (2S)-2-(N-mesyl-4-phenoxy-anilino)-N-[(1S)-1-methylpropyl]propionamide Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C(C)N(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC[C@H](C)NC(=O)[C@H](C)N(C1=CC=C(C=C1)OC2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C20H26N2O4S/c1-5-15(2)21-20(23)16(3)22(27(4,24)25)17-11-13-19(14-12-17)26-18-9-7-6-8-10-18/h6-16H,5H2,1-4H3,(H,21,23)/t15-,16-/m0/s1