(2S)-2-(2-naphthalen-1-ylethanoylamino)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: (2S)-2-(2-naphthalen-1-ylethanoylamino)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2S)-2-[[2-(1-naphthyl)acetyl]amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: (2S)-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: (2S)-2-[(2-naphthalen-1-ylacetyl)amino]-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2S)-2-[[2-(1-naphthyl)acetyl]amino]-N-(3-pyrrolidinosulfonylphenyl)propionamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H27N3O4S/c1-18(26-24(29)16-20-10-6-9-19-8-2-3-13-23(19)20)25(30)27-21-11-7-12-22(17-21)33(31,32)28-14-4-5-15-28/h2-3,6-13,17-18H,4-5,14-16H2,1H3,(H,26,29)(H,27,30)/t18-/m0/s1