| SpectraBase Spectrum ID |
272Rdd0Q8zc |
| Name |
3-[[3-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid |
| Alternate Name(s) |
3-[[3-[(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid
3-[[3-[[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-oxomethyl]phenyl]sulfonylamino]benzoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H21N3O5S2 |
| InChI |
InChI=1S/C24H21N3O5S2/c1-14-8-9-19-20(13-25)23(33-21(19)10-14)26-22(28)15-4-3-7-18(12-15)34(31,32)27-17-6-2-5-16(11-17)24(29)30/h2-7,11-12,14,27H,8-10H2,1H3,(H,26,28)(H,29,30) |
| InChIKey |
HETVTOOYSHCQGK-UHFFFAOYSA-N |
| Molecular Weight |
495.568 g/mol |
| SMILES |
N(c1c(c2CCC(Cc2s1)C)C#N)C(c1cc(S(Nc2cc(C(=O)O)ccc2)(=O)=O)ccc1)=O |
| SPLASH |
splash10-0udi-2918100000-07effc5eda90d911a4e3 |
| Wiley ID |
1442163 |
![3-[[3-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid](/api/spectrum/272Rdd0Q8zc/structure.png?h=300&w=458 "3-[[3-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]phenyl]sulfonylamino]benzoic acid")
