(2S)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-phenylsulfanyl-propanamide

Systemtic Name: (2S)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-2-phenylsulfanyl-propanamide Openeye Name: (2S)-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-2-phenylsulfanyl-propanamide CAS Name: (2S)-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-2-(phenylthio)propanamide IUPAC Name: (2S)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-2-phenylsulfanylpropanamide Traditional Name: (2S)-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-2-(phenylthio)propionamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCC3)SC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCC3)SC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O4S2/c1-18(31-19-7-3-2-4-8-19)23(27)24-21-17-20(9-10-22(21)25-11-5-6-12-25)32(28,29)26-13-15-30-16-14-26/h2-4,7-10,17-18H,5-6,11-16H2,1H3,(H,24,27)/t18-/m0/s1