Vitas-M small molecule compound
2-{[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-4-nitrophenyl)acetamide
Catalog ID
STL445331
SMILES COc1cc(ccc1NC(=O)CSc1nnc([nH]1)c1ccco1)[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 C15H13N5O5S MW 375.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N5O5S/c1-24-12-7-9(20(22)23)4-5-10(12)16-13(21)8-26-15-17-14(18-19-15)11-3-2-6-25-11/h2-7H,8H2,1H3,(H,16,21)(H,17,18,19)InChIKey
JDKYTIZGIYHKLH-UHFFFAOYSA-NSynonyms
2((5(FURAN2YL)1H124TRIAZOL3YL)SULFANYL)N(2METHOXY4NITROPHENYL)ACETAMIDE
2((5(furan2yl)4H124triazol3yl)sulfanyl)N(2methoxy4nitrophenyl)acetamide
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=O)CSC2=NNC(=N2)C3=CC=CO3
COc1cc(ccc1NC(=O)CSc1nnc((nH)1)c1ccco1)(N+)(=O)(O)
InChI=1SC15H13N5O5Sc1241279(20(22)23)4510(12)1613(21)826151714(181915)113262511h27H8H21H3(H1621)(H171819)
MFCD05842273
ZINC000014152350
ZINC14152350
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