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Vitas-M small molecule compound

(2E)-3-(1,3-benzodioxol-5-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)prop-2-enamide

Catalog ID
STK021377
SMILES COc1ccc2c(c1)sc(n2)NC(=O)/C=C/c1ccc2c(c1)OCO2

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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 C18H14N2O4S MW 354.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O4S/c1-22-12-4-5-13-16(9-12)25-18(19-13)20-17(21)7-3-11-2-6-14-15(8-11)24-10-23-14/h2-9H,10H2,1H3,(H,19,20,21)/b7-3+
InChIKey
NPLNQQGYDIXHQD-XVNBXDOJSA-N
Synonyms
1164475-16-4
(2E)3(13BENZODIOXOL5YL)N(6METHOXY13BENZOTHIAZOL2YL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(6METHOXY13BENZOTHIAZOL2YL)2PROPENAMIDE
(E)3(13BENZODIOXOL5YL)N(6METHOXY13BENZOTHIAZOL2YL)ACRYLAMIDE
(E)3(13BENZODIOXOL5YL)N(6METHOXY13BENZOTHIAZOL2YL)PROP2ENAMIDE
(E)3(benzo(d)(13)dioxol5yl)N(6methoxybenzo(d)thiazol2yl)acrylamide
1164475164
3(13BENZODIOXOL5YL)N(6METHOXY13BENZOTHIAZOL2YL)ACRYLAMIDE
COC1=CC2=C(C=C1)N=C(S2)NC(=O)C=CC3=CC4=C(C=C3)OCO4
COc1ccc2c(c1)sc(n2)NC(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC18H14N2O4Sc12212451316(912)2518(1913)2017(21)7311261415(811)24102314h29H10H21H3(H192021)b73+
MFCD02862669
STK021377
ZINC000008994400
ZINC08994400
ZINC8994400

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Available files

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

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