Vitas-M small molecule compound
(2E)-2-benzylidene-8-methyl-2H,6H-pyrimido[2,1-b][1,3,4]thiadiazine-3,6(4H)-dione
Catalog ID
STL437068
SMILES Cc1cc(=O)n2c(n1)s/c(=C/c1ccccc1)/c(=O)[nH]2
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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 C14H11N3O2S MW 285.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O2S/c1-9-7-12(18)17-14(15-9)20-11(13(19)16-17)8-10-5-3-2-4-6-10/h2-8H,1H3,(H,16,19)/b11-8+InChIKey
HCAHUSBZGHLYSH-DHZHZOJOSA-NSynonyms
(2E)2benzylidene8methyl2H6Hpyrimido(21b)(134)thiadiazine36(4H)dione
(2E)2BENZYLIDENE8METHYL4HPYRIMIDO(21B)(134)THIADIAZINE36DIONE
CC1=CC(=O)N2C(=N1)SC(=CC3=CC=CC=C3)C(=O)N2
Cc1cc(=O)n2c(n1)sc(=Cc1ccccc1)c(=O)(nH)2
InChI=1SC14H11N3O2Sc19712(18)1714(159)2011(13(19)1617)8105324610h28H1H3(H1619)b118+
MFCD06243739
ZINC000001407697
ZINC1407697
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