(2S)-1-[(2S,4S,5S)-5-methyl-4-thiomorpholin-4-ylcarbonyl-pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile

Systemtic Name: (2S)-1-[(2S,4S,5S)-5-methyl-4-thiomorpholin-4-ylcarbonyl-pyrrolidin-2-yl]carbonylpyrrolidine-2-carbonitrile Openeye Name: (2S)-1-[(2S,4S,5S)-5-methyl-4-(thiomorpholine-4-carbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile CAS Name: (2S)-1-[[(2S,4S,5S)-5-methyl-4-[oxo(thiomorpholin-4-yl)methyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbonitrile IUPAC Name: (2S)-1-[(2S,4S,5S)-5-methyl-4-(thiomorpholine-4-carbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonitrile Traditional Name: (2S)-1-[(2S,4S,5S)-5-methyl-4-(thiomorpholine-4-carbonyl)prolyl]pyrrolidine-2-carbonitrile Formula: C16H24N4O2S MolecularWeight: 336.45236

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CC(N1)C(=O)N2CCCC2C#N)C(=O)N3CCSCC3

Isomeric SMILES

C[C@H]1[C@H](C[C@H](N1)C(=O)N2CCC[C@H]2C#N)C(=O)N3CCSCC3

InChI

InChI=1S/C16H24N4O2S/c1-11-13(15(21)19-5-7-23-8-6-19)9-14(18-11)16(22)20-4-2-3-12(20)10-17/h11-14,18H,2-9H2,1H3/t11-,12-,13-,14-/m0/s1