Vitas-M small molecule compound
5-{2-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]hydrazinylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK119623
SMILES S=C1NC(=O)C(=NNc2ccc(cc2)c2nc3c(s2)cc(cc3)C)C(=O)N1
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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 C18H13N5O2S2 MW 395.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O2S2/c1-9-2-7-12-13(8-9)27-17(19-12)10-3-5-11(6-4-10)22-23-14-15(24)20-18(26)21-16(14)25/h2-8,22H,1H3,(H2,20,21,24,25,26)InChIKey
BBBITFDAJYZXCC-UHFFFAOYSA-NSynonyms
5((4(6METHYL13BENZOTHIAZOL2YL)PHENYL)HYDRAZINYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(2(4(6METHYL13BENZOTHIAZOL2YL)PHENYL)HYDRAZINYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NN=C4C(=O)NC(=S)NC4=O
InChI=1SC18H13N5O2S2c19271213(89)2717(1912)103511(6410)22231415(24)2018(26)2116(14)25h2822H1H3(H22021242526)
MFCD03163982
ZINC000005885194
ZINC5885194
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