Vitas-M small molecule compound

(2Z)-3-(1,3-benzodioxol-5-yl)-2-cyanoprop-2-enethioamide

Catalog ID
STL360950
SMILES N#C/C(=C/c1ccc2c(c1)OCO2)/C(=S)N

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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 C11H8N2O2S MW 232.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8N2O2S/c12-5-8(11(13)16)3-7-1-2-9-10(4-7)15-6-14-9/h1-4H,6H2,(H2,13,16)/b8-3-
InChIKey
RHTVPWVESMJUOP-BAQGIRSFSA-N
Synonyms

(2Z)3(13benzodioxol5yl)2cyanoprop2enethioamide
(E)3(benzo(d)(13)dioxol5yl)2cyanoprop2enethioamide
(Z)3(13BENZODIOXOL5YL)2CYANOPROP2ENETHIOAMIDE
3(2HBENZO(D)13DIOXOLAN5YL)(2Z)2(AMINOTHIOXOMETHYL)PROP2ENENITRILE
C1OC2=C(O1)C=C(C=C2)C=C(C#N)C(=S)N
InChI=1SC11H8N2O2Sc1258(11(13)16)3712910(47)156149h14H6H2(H21316)b83
MFCD00980977
N#CC(=Cc1ccc2c(c1)OCO2)C(=S)N
ZINC000000121486
ZINC00121486
ZINC121486

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Available files

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