(3S)-3-acetamido-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-propanamide

Systemtic Name: (3S)-3-acetamido-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-propanamide Openeye Name: (3S)-3-acetamido-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-3-phenyl-propanamide CAS Name: (3S)-3-acetamido-N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-3-phenylpropanamide IUPAC Name: (3S)-3-acetamido-N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-3-phenylpropanamide Traditional Name: (3S)-3-acetamido-N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-3-phenyl-propionamide Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CC(C2=CC=CC=C2)NC(=O)C)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[C@@H](C2=CC=CC=C2)NC(=O)C)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C23H29N3O5S/c1-3-31-21-12-11-19(15-22(21)32(29,30)26-13-7-8-14-26)25-23(28)16-20(24-17(2)27)18-9-5-4-6-10-18/h4-6,9-12,15,20H,3,7-8,13-14,16H2,1-2H3,(H,24,27)(H,25,28)/t20-/m0/s1