Vitas-M small molecule compound
ethyl 2-[({4-[2,3-dimethyl-5-oxo-4-(propan-2-yl)-2,5-dihydro-1H-pyrazol-1-yl]phenyl}sulfonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK666167
SMILES CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc(cc1)n1c(=O)c(c(n1C)C)C(C)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 C25H31N3O5S2 MW 517.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O5S2/c1-6-33-25(30)22-19-9-7-8-10-20(19)34-23(22)26-35(31,32)18-13-11-17(12-14-18)28-24(29)21(15(2)3)16(4)27(28)5/h11-15,26H,6-10H2,1-5H3InChIKey
FNSOGMSKDGGSJC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC=C(C=C3)N4C(=O)C(=C(N4C)C)C(C)C
ethyl2(((4(23dimethyl5oxo4(propan2yl)25dihydro1Hpyrazol1yl)phenyl)sulfonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((4(23dimethyl5oxo4propan2ylpyrazol1yl)phenyl)sulfonylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC25H31N3O5S2c163325(30)22199781020(19)3423(22)2635(3132)18131117(121418)2824(29)21(15(2)3)16(4)27(28)5h111526H610H215H3
MFCD06016568
ZINC000012413909
ZINC12413909
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