Vitas-M small molecule compound
4-(benzyl{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}amino)-N-(4-methoxyphenyl)tetrahydro-2H-thiopyran-4-carboxamide
Catalog ID
STL439442
SMILES COc1ccc(cc1)NC(=O)C1(CCSCC1)N(C(=O)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2)Cc1ccccc1
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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 C36H41N3O3S MW 595.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H41N3O3S/c1-24-32(28-12-8-9-13-30(28)37-24)33-29(35(33,2)3)22-31(40)39(23-25-10-6-5-7-11-25)36(18-20-43-21-19-36)34(41)38-26-14-16-27(42-4)17-15-26/h5-17,29,33,37H,18-23H2,1-4H3,(H,38,41)InChIKey
DOKMGPCXLYSFOA-UHFFFAOYSA-NSynonyms
4(benzyl((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)amino)N(4methoxyphenyl)tetrahydro2Hthiopyran4carboxamide
4(BENZYL(2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)AMINO)N(4METHOXYPHENYL)THIANE4CARBOXAMIDE
4(NBENZYL2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETAMIDO)N(4METHOXYPHENYL)TETRAHYDRO2HTHIOPYRAN4CARBOXAMIDE
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=CC=C4)C5(CCSCC5)C(=O)NC6=CC=C(C=C6)OC
COc1ccc(cc1)NC(=O)C1(CCSCC1)N(C(=O)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2)Cc1ccccc1
InChI=1SC36H41N3O3Sc12432(2812891330(28)3724)3329(35(332)3)2231(40)39(2325106571125)36(182043211936)34(41)3826141627(424)171526h517293337H1823H214H3(H3841)
MFCD29709826
ZINC000008749497
ZINC000101386100
Check stock
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Check stock on Vitas-MAvailable files
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