Vitas-M small molecule compound
1-(4-ethoxyphenyl)-3-[(2E)-5-(3-nitrophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
Catalog ID
STK847062
SMILES CCOc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)c1cccc(c1)[N+](=O)[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 C17H15N5O4S MW 385.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5O4S/c1-2-26-14-8-6-12(7-9-14)18-16(23)19-17-21-20-15(27-17)11-4-3-5-13(10-11)22(24)25/h3-10H,2H2,1H3,(H2,18,19,21,23)InChIKey
RPGNFKMLBPXTGN-UHFFFAOYSA-NSynonyms
426242-61-71(4ethoxyphenyl)3((2E)5(3nitrophenyl)134thiadiazol2(3H)ylidene)urea
1(4ETHOXYPHENYL)3(5(3NITROPHENYL)134THIADIAZOL2YL)UREA
426242617
CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)C3=CC(=CC=C3)(N+)(=O)(O)
CCOc1ccc(cc1)NC(=O)N=c1(nH)nc(s1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC17H15N5O4Sc1226148612(7914)1816(23)1917212015(2717)1143513(1011)22(24)25h310H2H21H3(H218192123)
MFCD03798659
ZINC000001747576
ZINC01747576
ZINC1747576
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