Vitas-M small molecule compound
3-(3-nitro-1H-1,2,4-triazol-1-yl)-N-[2-(phenylsulfanyl)phenyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STK960239
SMILES O=C(C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)[N+](=O)[O-])Nc1ccccc1Sc1ccccc1
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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 C25H25N5O3S MW 475.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O3S/c31-22(27-20-8-4-5-9-21(20)34-19-6-2-1-3-7-19)24-11-17-10-18(12-24)14-25(13-17,15-24)29-16-26-23(28-29)30(32)33/h1-9,16-18H,10-15H2,(H,27,31)InChIKey
SSICQKDGQZDKEN-UHFFFAOYSA-NSynonyms
445018-17-73(3NITRO124TRIAZOL1YL)N(2PHENYLSULFANYLPHENYL)ADAMANTANE1CARBOXAMIDE
3(3NITRO1H124TRIAZOL1YL)N(2(PHENYLSULFANYL)PHENYL)1ADAMANTANECARBOXAMIDE
3(3nitro1H124triazol1yl)N(2(phenylsulfanyl)phenyl)tricyclo(3311~37~)decane1carboxamide
445018177
C1C2CC3(CC1CC(C2)(C3)N4C=NC(=N4)(N+)(=O)(O))C(=O)NC5=CC=CC=C5SC6=CC=CC=C6
InChI=1SC25H25N5O3Sc3122(2720845921(20)34196213719)2411171018(1224)1425(13171524)29162623(2829)30(32)33h191618H1015H2(H2731)
O=C(C12CC3CC(C1)CC(C2)(C3)n1cnc(n1)(N+)(=O)(O))Nc1ccccc1Sc1ccccc1
ZINC000017136224
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