Vitas-M small molecule compound
methyl [(2Z)-3-methyl-2-{[5-(methylcarbamoyl)-1H-imidazol-4-yl]imino}-4-oxo-1,3-thiazolidin-5-yl]acetate
Catalog ID
STL439971
SMILES COC(=O)CC1S/C(=N\c2nc[nH]c2C(=O)NC)/N(C1=O)C
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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 C12H15N5O4S MW 325.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N5O4S/c1-13-10(19)8-9(15-5-14-8)16-12-17(2)11(20)6(22-12)4-7(18)21-3/h5-6H,4H2,1-3H3,(H,13,19)(H,14,15)/b16-12-InChIKey
SOWWNLPFBZFURV-VBKFSLOCSA-NSynonyms
CNC(=O)C1=C(N=CN1)N=C2N(C(=O)C(S2)CC(=O)OC)C
COC(=O)CC1SC(=Nc2nc(nH)c2C(=O)NC)N(C1=O)C
InChI=1SC12H15N5O4Sc11310(19)89(155148)161217(2)11(20)6(2212)47(18)213h56H4H213H3(H1319)(H1415)b1612
methyl((2Z)3methyl2((5(methylcarbamoyl)1Himidazol4yl)imino)4oxo13thiazolidin5yl)acetate
METHYL2((2Z)3METHYL2((5(METHYLCARBAMOYL)1HIMIDAZOL4YL)IMINO)4OXO13THIAZOLIDIN5YL)ACETATE
MFCD06240093
ZINC000016956795
ZINC000016956797
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