Vitas-M small molecule compound
methyl 3-{[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]carbamoyl}-5-nitrobenzoate
Catalog ID
STK064795
SMILES CCOC(=O)Cc1csc(n1)NC(=O)c1cc(cc(c1)C(=O)OC)[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 C16H15N3O7S MW 393.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O7S/c1-3-26-13(20)7-11-8-27-16(17-11)18-14(21)9-4-10(15(22)25-2)6-12(5-9)19(23)24/h4-6,8H,3,7H2,1-2H3,(H,17,18,21)InChIKey
RRSYEOCSLDXZDP-UHFFFAOYSA-NSynonyms
349439-91-4CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)OC
CCOC(=O)Cc1csc(n1)NC(=O)c1cc(cc(c1)C(=O)OC)(N+)(=O)(O)
ETHYL2(2((5(METHOXYCARBONYL)3NITROPHENYL)CARBONYLAMINO)13THIAZOL4YL)ACETATE
InChI=1SC16H15N3O7Sc132613(20)71182716(1711)1814(21)9410(15(22)252)612(59)19(23)24h468H37H212H3(H171821)
METHYL3(((2Z)4(2ETHOXY2OXOETHYL)13THIAZOL2(3H)YLIDENE)CARBAMOYL)5NITROBENZOATE
METHYL3((4(2ETHOXY2OXOETHYL)13THIAZOL2YL)CARBAMOYL)5NITROBENZOATE
methyl3((4(2ethoxy2oxoethyl)thiazol2yl)carbamoyl)5nitrobenzoate
MFCD02603887
STK064795
ZINC000009331422
ZINC09331422
ZINC9331422
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