Vitas-M small molecule compound
4-[{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}(2-fluorobenzyl)amino]-N-(2,4,6-trimethylphenyl)tetrahydro-2H-thiopyran-4-carboxamide
Catalog ID
STL439448
SMILES Cc1cc(C)c(c(c1)C)NC(=O)C1(CCSCC1)N(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccccc1F
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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 C38H44FN3O2S MW 625.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H44FN3O2S/c1-23-19-24(2)35(25(3)20-23)41-36(44)38(15-17-45-18-16-38)42(22-27-11-7-9-13-30(27)39)32(43)21-29-34(37(29,5)6)33-26(4)40-31-14-10-8-12-28(31)33/h7-14,19-20,29,34,40H,15-18,21-22H2,1-6H3,(H,41,44)InChIKey
FPFROOPMDSRCQH-UHFFFAOYSA-NSynonyms
4(((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)(2fluorobenzyl)amino)N(246trimethylphenyl)tetrahydro2Hthiopyran4carboxamide
4((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)((2FLUOROPHENYL)METHYL)AMINO)N(246TRIMETHYLPHENYL)THIANE4CARBOXAMIDE
4(2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(2FLUOROBENZYL)ACETAMIDO)NMESITYLTETRAHYDRO2HTHIOPYRAN4CARBOXAMIDE
CC1=CC(=C(C(=C1)C)NC(=O)C2(CCSCC2)N(CC3=CC=CC=C3F)C(=O)CC4C(C4(C)C)C5=C(NC6=CC=CC=C65)C)C
Cc1cc(C)c(c(c1)C)NC(=O)C1(CCSCC1)N(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccccc1F
InChI=1SC38H44FN3O2Sc1231924(2)35(25(3)2023)4136(44)38(151745181638)42(222711791330(27)39)32(43)212934(37(295)6)3326(4)4031141081228(31)33h7141920293440H15182122H216H3(H4144)
MFCD29709831
ZINC000008749532
ZINC000101386077
Check stock
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Check stock on Vitas-MAvailable files
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