Vitas-M small molecule compound
methyl (2E)-{(2Z)-2-[(5-carbamoyl-1H-imidazol-4-yl)imino]-3-ethyl-4-oxo-1,3-thiazolidin-5-ylidene}ethanoate
Catalog ID
STL439888
SMILES CCN1/C(=N/c2nc[nH]c2C(=O)N)/S/C(=C/C(=O)OC)/C1=O
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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 C12H13N5O4S MW 323.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N5O4S/c1-3-17-11(20)6(4-7(18)21-2)22-12(17)16-10-8(9(13)19)14-5-15-10/h4-5H,3H2,1-2H3,(H2,13,19)(H,14,15)/b6-4+,16-12-InChIKey
HTPFQODIRBMBOT-BZFXXSNLSA-NSynonyms
CCN1C(=Nc2nc(nH)c2C(=O)N)SC(=CC(=O)OC)C1=O
CCN1C(=O)C(=CC(=O)OC)SC1=NC2=C(NC=N2)C(=O)N
InChI=1SC12H13N5O4Sc131711(20)6(47(18)212)2212(17)16108(9(13)19)1451510h45H3H212H3(H21319)(H1415)b64+1612
methyl(2E)((2Z)2((5carbamoyl1Himidazol4yl)imino)3ethyl4oxo13thiazolidin5ylidene)ethanoate
methyl(2E)2((2Z)2((5carbamoyl1Himidazol4yl)imino)3ethyl4oxo13thiazolidin5ylidene)acetate
MFCD06240091
ZINC000004817898
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