Vitas-M small molecule compound

(2E)-2-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxybenzylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide

Catalog ID
STL168709
SMILES C=CCNC(=S)N/N=C/c1ccc(c(c1)CSc1nc2c(s1)cccc2)OC

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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 C20H20N4OS3 MW 428.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS3/c1-3-10-21-19(26)24-22-12-14-8-9-17(25-2)15(11-14)13-27-20-23-16-6-4-5-7-18(16)28-20/h3-9,11-12H,1,10,13H2,2H3,(H2,21,24,26)/b22-12+
InChIKey
HJDTWQKQUPCSAY-WSDLNYQXSA-N
Synonyms
529490-71-9
(2E)2(3((13benzothiazol2ylsulfanyl)methyl)4methoxybenzylidene)N(prop2en1yl)hydrazinecarbothioamide
(E)Nallyl2(3((benzo(d)thiazol2ylthio)methyl)4methoxybenzylidene)hydrazinecarbothioamide
1((E)(3(13BENZOTHIAZOL2YLSULFANYLMETHYL)4METHOXYPHENYL)METHYLIDENEAMINO)3PROP2ENYLTHIOUREA
529490719
C=CCNC(=S)NN=Cc1ccc(c(c1)CSc1nc2c(s1)cccc2)OC
COC1=C(C=C(C=C1)C=NNC(=S)NCC=C)CSC2=NC3=CC=CC=C3S2
InChI=1SC20H20N4OS3c13102119(26)242212148917(252)15(1114)1327202316645718(16)2820h391112H11013H22H3(H2212426)b2212+
MFCD03561086
ZINC000002220915
ZINC33350814

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Available files

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