SpectraBase Spectrum ID |
iI9s2vLVea |
Name |
Dothiepin sulfoxide |
CAS Registry Number |
1447-71-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H21NOS |
InChI |
InChI=1S/C19H21NOS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-22(21)19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11+ |
InChIKey |
NBNPVRZHUPMVQS-GZTJUZNOSA-N |
Molecular Weight |
311.443 g/mol |
SMILES |
c12S(Cc3c(\C(c2cccc1)=C\CCN(C)C)cccc3)=O |
SPLASH |
splash10-0a4i-9000000000-5442165014bd3d564831 |
Source of Spectrum |
JZ-1992-1617-0 |
Synonyms |
(3E)-N,N-dimethyl-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propan-1-amine
1-Propanamine, 3-dibenzo[b,e]thiepin-11(6H)-ylidene-N,N-dimethyl-, S-oxide |
Wiley ID |
1312542 |