SpectraBase Spectrum ID |
JecNx3ea2Im |
Name |
(+-)-1-[[N-[2'-(3',4'-Dimethoxyphenyl)ethyl]amino]methyl]-4-(p-methoxyphenyl)-4H-pyrrolo[2,1-c][1,4]benzothiazine |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C29H30N2O3S |
InChI |
InChI=1S/C29H30N2O3S/c1-32-23-12-9-21(10-13-23)29-25-14-11-22(31(25)24-6-4-5-7-28(24)35-29)19-30-17-16-20-8-15-26(33-2)27(18-20)34-3/h4-15,18,29-30H,16-17,19H2,1-3H3 |
InChIKey |
FUMZQPBWMHAUOB-UHFFFAOYSA-N |
Molecular Weight |
486.630 g/mol |
SMILES |
N(Cc1[n]-2c(C(Sc3ccccc23)c2ccc(cc2)OC)cc1)CCc1cc(OC)c(cc1)OC |
SPLASH |
splash10-0a4i-0009400000-a1cfc00cbff1ee46cf58 |
Source of Spectrum |
E1-38-4405-11 |
Synonyms |
2-(3,4-dimethoxyphenyl)-N-{[4-(4-methoxyphenyl)-4H-pyrrolo[2,1-c][1,4]benzothiazin-1-yl]methyl}ethanamine
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-{[4-(4-methoxyphenyl)-4H-pyrrolo[2,1-c][1,4]benzothiazin-1-yl]methyl}amine
2-(3,4-dimethoxyphenyl)-N-[[4-(4-methoxyphenyl)-4H-pyrrolo[2,1-c][1,4]benzothiazin-1-yl]methyl]ethanamine |
Wiley ID |
1598530 |