(4-methoxyphenyl)-[(3S,4S)-3-oxidanyl-4-thiomorpholin-4-yl-pyrrolidin-1-yl]methanone

Systemtic Name: (4-methoxyphenyl)-[(3S,4S)-3-oxidanyl-4-thiomorpholin-4-yl-pyrrolidin-1-yl]methanone Openeye Name: [(3S,4S)-3-hydroxy-4-thiomorpholino-pyrrolidin-1-yl]-(4-methoxyphenyl)methanone CAS Name: [(3S,4S)-3-hydroxy-4-thiomorpholin-4-yl-1-pyrrolidinyl]-(4-methoxyphenyl)methanone IUPAC Name: [(3S,4S)-3-hydroxy-4-thiomorpholin-4-ylpyrrolidin-1-yl]-(4-methoxyphenyl)methanone Traditional Name: [(3S,4S)-3-hydroxy-4-thiomorpholino-pyrrolidino]-(4-methoxyphenyl)methanone Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CC(C(C2)O)N3CCSCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2C[C@@H]([C@H](C2)O)N3CCSCC3

InChI

InChI=1S/C16H22N2O3S/c1-21-13-4-2-12(3-5-13)16(20)18-10-14(15(19)11-18)17-6-8-22-9-7-17/h2-5,14-15,19H,6-11H2,1H3/t14-,15-/m0/s1