| SpectraBase Spectrum ID |
4hSzBu1pwSg |
| Name |
2H-1-Benzothiocin-4,5-dicarboxylic acid, 3-(1-pyrrolidinyl)-, dimethyl ester |
| CAS Registry Number |
78031-60-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H21NO4S |
| InChI |
InChI=1S/C19H21NO4S/c1-23-18(21)14-11-13-7-3-4-8-16(13)25-12-15(17(14)19(22)24-2)20-9-5-6-10-20/h3-4,7-8,11H,5-6,9-10,12H2,1-2H3/b14-11+,17-15- |
| InChIKey |
UWZRRGVPMKXYMH-VDRZCLTPSA-N |
| Molecular Weight |
359.440 g/mol |
| SMILES |
c12\C=C/(\C(=C/(CSc1cccc2)N1CCCC1)C(=O)OC)C(=O)OC |
| SPLASH |
splash10-004i-0009000000-8973071c4f6044557e38 |
| Source of Spectrum |
SB-35-199-0 |
| Synonyms |
4,5-bis-methoxycarbonyl-3-(pyrrolidinyl-2H-benzo[b]thiocin
Dimethyl 3-(1-pyrrolidinyl)-2H-1-benzothiocin-4,5-dicarboxylate
Dimethyl 3-(1-pyrrolidinyl)benzo[b]thiocin-4,5-dicarboxylate |
| Wiley ID |
1347733 |
