(2S)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-2-(4-methylphenoxy)butanamide

Systemtic Name: (2S)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-2-(4-methylphenoxy)butanamide Openeye Name: (2S)-N-(4-indolin-1-ylsulfonylphenyl)-2-(4-methylphenoxy)butanamide CAS Name: (2S)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-2-(4-methylphenoxy)butanamide IUPAC Name: (2S)-N-[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-2-(4-methylphenoxy)butanamide Traditional Name: (2S)-N-(4-indolin-1-ylsulfonylphenyl)-2-(4-methylphenoxy)butyramide Formula: C25H26N2O4S MolecularWeight: 450.54994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)OC4=CC=C(C=C4)C

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)OC4=CC=C(C=C4)C

InChI

InChI=1S/C25H26N2O4S/c1-3-24(31-21-12-8-18(2)9-13-21)25(28)26-20-10-14-22(15-11-20)32(29,30)27-17-16-19-6-4-5-7-23(19)27/h4-15,24H,3,16-17H2,1-2H3,(H,26,28)/t24-/m0/s1