Vitas-M small molecule compound

3,4,5-trimethoxy-N-[(2E)-6-(morpholin-4-ylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]benzamide

Catalog ID
STK847438
SMILES COc1cc(cc(c1OC)OC)C(=O)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCOCC1

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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 C21H23N3O7S2 MW 493.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O7S2/c1-28-16-10-13(11-17(29-2)19(16)30-3)20(25)23-21-22-15-5-4-14(12-18(15)32-21)33(26,27)24-6-8-31-9-7-24/h4-5,10-12H,6-9H2,1-3H3,(H,22,23,25)
InChIKey
BOQMKMYAQCBHSN-UHFFFAOYSA-N
Synonyms
706767-72-8
345trimethoxyN((2E)6(morpholin4ylsulfonyl)13benzothiazol2(3H)ylidene)benzamide
345TRIMETHOXYN(6(4MORPHOLINYLSULFONYL)13BENZOTHIAZOL2YL)BENZAMIDE
345TRIMETHOXYN(6(MORPHOLINOSULFONYL)BENZO(D)THIAZOL2YL)BENZAMIDE
345TRIMETHOXYN(6MORPHOLIN4YLSULFONYL13BENZOTHIAZOL2YL)BENZAMIDE
706767728
COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCOCC4
COc1cc(cc(c1OC)OC)C(=O)N=c1sc2c((nH)1)ccc(c2)S(=O)(=O)N1CCOCC1
InChI=1SC21H23N3O7S2c128161013(1117(292)19(16)303)20(25)232122155414(1218(15)3221)33(2627)2468319724h451012H69H213H3(H222325)
MFCD05738650
N(6(MORPHOLIN4YLSULFONYL)BENZOTHIAZOL2YL)(345TRIMETHOXYPHENYL)CARBOXAMIDE
ZINC000002595983
ZINC02595983
ZINC2595983

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.