Vitas-M small molecule compound
(2E)-3-(3-bromophenyl)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
Catalog ID
STK701937
SMILES N#C/C(=C\c1cccc(c1)Br)/C(=O)NC1CCS(=O)(=O)C1
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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 C14H13BrN2O3S MW 369.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13BrN2O3S/c15-12-3-1-2-10(7-12)6-11(8-16)14(18)17-13-4-5-21(19,20)9-13/h1-3,6-7,13H,4-5,9H2,(H,17,18)/b11-6+InChIKey
LGEOBQMBJJWQAO-IZZDOVSWSA-NSynonyms
(2E)3(3bromophenyl)2cyanoN(11dioxidotetrahydrothiophen3yl)prop2enamide
(E)3(3BROMOPHENYL)2CYANON(11DIOXOTHIOLAN3YL)PROP2ENAMIDE
C1CS(=O)(=O)CC1NC(=O)C(=CC2=CC(=CC=C2)Br)C#N
InChI=1SC14H13BrN2O3Sc151231210(712)611(816)14(18)17134521(1920)913h136713H459H2(H1718)b116+
MFCD03461699
N#CC(=Cc1cccc(c1)Br)C(=O)NC1CCS(=O)(=O)C1
ZINC000001462168
ZINC000002697025
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