Vitas-M small molecule compound
methyl (2Z)-2-{[(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetyl]imino}-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL248303
SMILES COC(=O)c1[nH]/c(=N/C(=O)Cn2nnc3c(c2=O)cccc3)/sc1C(C)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 C17H17N5O4S MW 387.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O4S/c1-9(2)14-13(16(25)26-3)19-17(27-14)18-12(23)8-22-15(24)10-6-4-5-7-11(10)20-21-22/h4-7,9H,8H2,1-3H3,(H,18,19,23)InChIKey
IBYVBYKCFZWEGQ-UHFFFAOYSA-NSynonyms
1351700-95-21351700952
CC(C)C1=C(N=C(S1)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)Cn2nnc3c(c2=O)cccc3)sc1C(C)C
InChI=1SC17H17N5O4Sc19(2)1413(16(25)263)1917(2714)1812(23)82215(24)10645711(10)202122h479H8H213H3(H181923)
methyl(2Z)2(((4oxo123benzotriazin3(4H)yl)acetyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((2(4oxo123benzotriazin3yl)acetyl)amino)5propan2yl13thiazole4carboxylate
MFCD24861161
ZINC000072401286
ZINC72401286
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