Vitas-M small molecule compound

(2E)-3-(2-chlorophenyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)prop-2-enamide

Catalog ID
STK034467
SMILES O=C(Nc1nc2c(s1)CCCC2)/C=C/c1ccccc1Cl

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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 C16H15ClN2OS MW 318.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN2OS/c17-12-6-2-1-5-11(12)9-10-15(20)19-16-18-13-7-3-4-8-14(13)21-16/h1-2,5-6,9-10H,3-4,7-8H2,(H,18,19,20)/b10-9+
InChIKey
MKHXLMMNUFLDRZ-MDZDMXLPSA-N
Synonyms
476325-50-5
(2E)3(2chlorophenyl)N(4567tetrahydro13benzothiazol2yl)prop2enamide
(E)3(2chlorophenyl)N(4567tetrahydro13benzothiazol2yl)prop2enamide
476325505
C1CCC2=C(C1)N=C(S2)NC(=O)C=CC3=CC=CC=C3Cl
InChI=1SC16H15ClN2OSc1712621511(12)91015(20)19161813734814(13)2116h1256910H3478H2(H181920)b109+
MFCD03716189
O=C(Nc1nc2c(s1)CCCC2)C=Cc1ccccc1Cl
STK034467
ZINC000000474787
ZINC00474787
ZINC474787

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Available files

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