Vitas-M small molecule compound
2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl pyridine-3-carboxylate
Catalog ID
STK180056
SMILES Cc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)CCOC(=O)c1cccnc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-16-8-10-18(11-9-16)25(13-14-29-22(26)17-5-4-12-23-15-17)21-19-6-2-3-7-20(19)30(27,28)24-21/h2-12,15H,13-14H2,1H3InChIKey
MBWYWICXOTXPDB-UHFFFAOYSA-NSynonyms
2((11DIOXIDO12BENZISOTHIAZOL3YL)4METHYLANILINO)ETHYLNICOTINATE
2((11DIOXIDO12BENZOTHIAZOL3YL)(4METHYLPHENYL)AMINO)ETHYLPYRIDINE3CARBOXYLATE
2(N(11DIOXO12BENZOTHIAZOL3YL)4METHYLANILINO)ETHYLPYRIDINE3CARBOXYLATE
CC1=CC=C(C=C1)N(CCOC(=O)C2=CN=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43
InChI=1SC22H19N3O4Sc11681018(11916)25(13142922(26)175412231517)2119623720(19)30(2728)2421h21215H1314H21H3
MFCD04084656
ZINC000001461833
ZINC01461833
ZINC1461833
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