Vitas-M small molecule compound
N-(4-ethoxyphenyl)-2-({4-methyl-5-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK771965
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1C)Cn1cnc(n1)[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 C16H18N8O4S MW 418.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N8O4S/c1-3-28-12-6-4-11(5-7-12)18-14(25)9-29-16-20-19-13(22(16)2)8-23-10-17-15(21-23)24(26)27/h4-7,10H,3,8-9H2,1-2H3,(H,18,25)InChIKey
RMNKEIIMFNDAKN-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)CN3C=NC(=N3)(N+)(=O)(O)
CCOc1ccc(cc1)NC(=O)CSc1nnc(n1C)Cn1cnc(n1)(N+)(=O)(O)
InChI=1SC16H18N8O4Sc1328126411(5712)1814(25)92916201913(22(16)2)823101715(2123)24(26)27h4710H389H212H3(H1825)
MFCD03767882
N(4ETHOXYPHENYL)2((4METHYL5((3NITRO124TRIAZOL1YL)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4ethoxyphenyl)2((4methyl5((3nitro1H124triazol1yl)methyl)4H124triazol3yl)sulfanyl)acetamide
N(4ETHOXYPHENYL)2((4METHYL5((3NITRO1H124TRIAZOL1YL)METHYL)4H124TRIAZOL3YL)THIO)ACETAMIDE
ZINC000003624456
ZINC03624456
ZINC3624456
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