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cis-6,7-Dihydro-6-hydroxy-7-(4-methoxyphenyl)-4-[(2-Dimethylamino)ethyl]thieno[2,3-b][1,4]thiazepin-5(4H)-one
SpectraBase Compound ID 4Ld0kAnPtQy
InChI InChI=1S/C18H22N2O3S2/c1-19(2)9-10-20-14-8-11-24-18(14)25-16(15(21)17(20)22)12-4-6-13(23-3)7-5-12/h4-8,11,15-16,21H,9-10H2,1-3H3/t15-,16+/m1/s1
InChIKey KVWWRBDWHAKGFB-CVEARBPZSA-N
Mol Weight 378.51 g/mol
Molecular Formula C18H22N2O3S2
Exact Mass 378.107185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SlCgolJwN3
Name cis-6,7-Dihydro-6-hydroxy-7-(4-methoxyphenyl)-4-[(2-Dimethylamino)ethyl]thieno[2,3-b][1,4]thiazepin-5(4H)-one
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Formula C18H22N2O3S2
InChI InChI=1S/C18H22N2O3S2/c1-19(2)9-10-20-14-8-11-24-18(14)25-16(15(21)17(20)22)12-4-6-13(23-3)7-5-12/h4-8,11,15-16,21H,9-10H2,1-3H3/t15-,16+/m1/s1
InChIKey KVWWRBDWHAKGFB-CVEARBPZSA-N
Molecular Weight 378.505 g/mol
SMILES O[C@]1(C(N(c2c(S[C@]1(c1ccc(cc1)OC)[H])scc2)CCN(C)C)=O)[H]
SPLASH splash10-0a4i-9001000000-69184881336dc54d75fb
Source of Spectrum H1-41-718-18
Synonyms (6S,7S)-4-(2-dimethylaminoethyl)-6-hydroxy-7-(4-methoxyphenyl)-6,7-dihydrothieno[2,3-b][1,4]thiazepin-5-one (6S,7S)-4-(2-dimethylaminoethyl)-7-(4-methoxyphenyl)-6-oxidanyl-6,7-dihydrothieno[2,3-b][1,4]thiazepin-5-one (6S,7S)-4-[2-(dimethylamino)ethyl]-6-hydroxy-7-(4-methoxyphenyl)-6,7-dihydrothieno[2,3-b][1,4]thiazepin-5(4H)-one (6S,7S)-4-[2-(dimethylamino)ethyl]-7-(4-methoxyphenyl)-6-oxidanyl-6,7-dihydrothieno[2,3-b][1,4]thiazepin-5-one
Wiley ID 757212