Vitas-M small molecule compound
methyl 2-({[7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL400276
SMILES COC(=O)c1c(sc2c1CCC(C2)c1ccccc1)NC(=O)c1cnn2c1nc(cc2C(F)F)c1ccccc1
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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 C30H24F2N4O3S MW 558.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24F2N4O3S/c1-39-30(38)25-20-13-12-19(17-8-4-2-5-9-17)14-24(20)40-29(25)35-28(37)21-16-33-36-23(26(31)32)15-22(34-27(21)36)18-10-6-3-7-11-18/h2-11,15-16,19,26H,12-14H2,1H3,(H,35,37)InChIKey
ZWILIWUKMBFJCT-UHFFFAOYSA-NSynonyms
445038-43-7445038437
COC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)C4=C5N=C(C=C(N5N=C4)C(F)F)C6=CC=CC=C6
InChI=1SC30H24F2N4O3Sc13930(38)2520131219(178425917)1424(20)4029(25)3528(37)2116333623(26(31)32)1522(3427(21)36)18106371118h21115161926H1214H21H3(H3537)
methyl2(((7(difluoromethyl)5phenylpyrazolo(15a)pyrimidin3yl)carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
methyl2((7(difluoromethyl)5phenylpyrazolo(15a)pyrimidine3carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
MFCD02243851
ZINC000002107780
ZINC000002107782
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