(6S,7S)-7-(4-methoxyphenyl)-6-oxidanyl-1,4-thiazepan-5-one

Systemtic Name: (6S,7S)-7-(4-methoxyphenyl)-6-oxidanyl-1,4-thiazepan-5-one Openeye Name: (6S,7S)-6-hydroxy-7-(4-methoxyphenyl)-1,4-thiazepan-5-one CAS Name: (6S,7S)-6-hydroxy-7-(4-methoxyphenyl)-1,4-thiazepan-5-one IUPAC Name: (6S,7S)-6-hydroxy-7-(4-methoxyphenyl)-1,4-thiazepan-5-one Traditional Name: (6S,7S)-6-hydroxy-7-(4-methoxyphenyl)-1,4-thiazepan-5-one Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(=O)NCCS2)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2[C@H](C(=O)NCCS2)O

InChI

InChI=1S/C12H15NO3S/c1-16-9-4-2-8(3-5-9)11-10(14)12(15)13-6-7-17-11/h2-5,10-11,14H,6-7H2,1H3,(H,13,15)/t10-,11+/m1/s1