| SpectraBase Spectrum ID |
EbnBNIoVwam |
| Name |
cis-4-( 2'-Dimethylaminoethyl)-2-ethyl-4,5,6,7-tetrahydro-7-( 4'-methoxyphenyl)-5-oxothieno[2,3-b][1,4]thiazepin-6'-yl) acetate |
| Alternate Name(s) |
(6S,7S)-4-[2-(dimethylamino)ethyl]-2-ethyl-7-(4-methoxyphenyl)-5-oxo-4,5,6,7-tetrahydrothieno[2,3-b][1,4]thiazepin-6-yl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28N2O4S2 |
| InChI |
InChI=1S/C22H28N2O4S2/c1-6-17-13-18-22(29-17)30-20(15-7-9-16(27-5)10-8-15)19(28-14(2)25)21(26)24(18)12-11-23(3)4/h7-10,13,19-20H,6,11-12H2,1-5H3/t19-,20+/m1/s1 |
| InChIKey |
HLTMKXAGBCQQQU-UXHICEINSA-N |
| Molecular Weight |
448.596 g/mol |
| SMILES |
c12c(N(C(=O)[C@@]([C@@](S2)(c2ccc(cc2)OC)[H])(OC(=O)C)[H])CCN(C)C)cc(s1)CC |
| SPLASH |
splash10-052b-7000900000-b9c2cb79cbf175a3fa29 |
| Source of Spectrum |
AH-126-573-3 |
| Wiley ID |
1387099 |
![cis-4-( 2'-Dimethylaminoethyl)-2-ethyl-4,5,6,7-tetrahydro-7-( 4'-methoxyphenyl)-5-oxothieno[2,3-b][1,4]thiazepin-6'-yl) acetate](/api/spectrum/EbnBNIoVwam/structure.png?h=300&w=458 "cis-4-( 2'-Dimethylaminoethyl)-2-ethyl-4,5,6,7-tetrahydro-7-( 4'-methoxyphenyl)-5-oxothieno[2,3-b][1,4]thiazepin-6'-yl) acetate")
