Vitas-M small molecule compound
N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-2-{[5-(1,3-dimethyl-1H-pyrazol-5-yl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK305084
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2sc3c(c2C#N)CCC3)nnc1c1cc(nn1C)C
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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 C25H25N7O2S2 MW 519.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N7O2S2/c1-4-34-17-10-8-16(9-11-17)32-23(20-12-15(2)30-31(20)3)28-29-25(32)35-14-22(33)27-24-19(13-26)18-6-5-7-21(18)36-24/h8-12H,4-7,14H2,1-3H3,(H,27,33)InChIKey
MJVLLHVAMGPJDZ-UHFFFAOYSA-NSynonyms
1005575-58-51005575585
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C4=C(S3)CCC4)C#N)C5=CC(=NN5C)C
InChI=1SC25H25N7O2S2c14341710816(91117)3223(201215(2)3031(20)3)282925(32)351422(33)272419(1326)1865721(18)3624h812H4714H213H3(H2733)
MFCD04049344
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)2((5(13dimethyl1Hpyrazol5yl)4(4ethoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(3cyano56dihydro4Hcyclopenta(b)thiophen2yl)2((5(25dimethylpyrazol3yl)4(4ethoxyphenyl)124triazol3yl)sulfanyl)acetamide
ZINC000002783953
ZINC02783953
ZINC2783953
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