Vitas-M small molecule compound
2-benzyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-oxopyrazolidine-3-carboxamide
Catalog ID
STL019778
SMILES N#Cc1c(NC(=O)C2CC(=O)NN2Cc2ccccc2)sc2c1CCCC2
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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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c21-11-15-14-8-4-5-9-17(14)27-20(15)22-19(26)16-10-18(25)23-24(16)12-13-6-2-1-3-7-13/h1-3,6-7,16H,4-5,8-10,12H2,(H,22,26)(H,23,25)InChIKey
MHEJITUAOCJCSB-UHFFFAOYSA-NSynonyms
957014-79-82benzylN(3cyano4567tetrahydro1benzothiophen2yl)5oxopyrazolidine3carboxamide
957014798
C1CCC2=C(C1)C(=C(S2)NC(=O)C3CC(=O)NN3CC4=CC=CC=C4)C#N
InChI=1SC20H20N4O2Sc21111514845917(14)2720(15)2219(26)161018(25)2324(16)12136213713h136716H4581012H2(H2226)(H2325)
MFCD04065729
ZINC000000645058
ZINC000000645060
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