(2S,3S)-2-azanyl-4-cyclopropyl-3-[3-(4-methylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-yl-butan-1-one

Systemtic Name: (2S,3S)-2-azanyl-4-cyclopropyl-3-[3-(4-methylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-yl-butan-1-one Openeye Name: (2S,3S)-2-amino-4-cyclopropyl-3-[3-(4-methylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-yl-butan-1-one CAS Name: (2S,3S)-2-amino-4-cyclopropyl-3-[3-(4-methylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]-1-(1-pyrrolidinyl)-1-butanone IUPAC Name: (2S,3S)-2-amino-4-cyclopropyl-3-[3-(4-methylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidin-1-ylbutan-1-one Traditional Name: (2S,3S)-2-amino-4-cyclopropyl-3-[3-(4-mesylphenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidino-butan-1-one Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=NOC(=N2)C(CC3CC3)C(C(=O)N4CCCC4)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=NOC(=N2)[C@@H](CC3CC3)[C@@H](C(=O)N4CCCC4)N

InChI

InChI=1S/C20H26N4O4S/c1-29(26,27)15-8-6-14(7-9-15)18-22-19(28-23-18)16(12-13-4-5-13)17(21)20(25)24-10-2-3-11-24/h6-9,13,16-17H,2-5,10-12,21H2,1H3/t16-,17-/m0/s1