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N-[4-(dimethylamino)phenyl]-4-[{[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]acetyl}(2-fluorobenzyl)amino]tetrahydro-2H-thiopyran-4-carboxamide

Catalog ID
STL439446
SMILES O=C(N(C1(CCSCC1)C(=O)Nc1ccc(cc1)N(C)C)Cc1ccccc1F)CC1C(C1(C)C)c1c(C)[nH]c2c1cccc2

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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 C37H43FN4O2S MW 626.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H43FN4O2S/c1-24-33(28-11-7-9-13-31(28)39-24)34-29(36(34,2)3)22-32(43)42(23-25-10-6-8-12-30(25)38)37(18-20-45-21-19-37)35(44)40-26-14-16-27(17-15-26)41(4)5/h6-17,29,34,39H,18-23H2,1-5H3,(H,40,44)
InChIKey
YBQZQPMLUQEDHX-UHFFFAOYSA-N
Synonyms

4(2((1R3S)22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)N(2FLUOROBENZYL)ACETAMIDO)N(4(DIMETHYLAMINO)PHENYL)TETRAHYDRO2HTHIOPYRAN4CARBOXAMIDE
CC1=C(C2=CC=CC=C2N1)C3C(C3(C)C)CC(=O)N(CC4=CC=CC=C4F)C5(CCSCC5)C(=O)NC6=CC=C(C=C6)N(C)C
InChI=1SC37H43FN4O2Sc12433(2811791331(28)3924)3429(36(342)3)2232(43)42(232510681230(25)38)37(182045211937)35(44)4026141627(171526)41(4)5h617293439H1823H215H3(H4044)
MFCD29709829
N(4(dimethylamino)phenyl)4(((22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)(2fluorobenzyl)amino)tetrahydro2Hthiopyran4carboxamide
N(4(dimethylamino)phenyl)4((2(22dimethyl3(2methyl1Hindol3yl)cyclopropyl)acetyl)((2fluorophenyl)methyl)amino)thiane4carboxamide
N(4DIMETHYLAMINOPHENYL)4((2(22DIMETHYL3(2METHYL1HINDOL3YL)CYCLOPROPYL)ACETYL)((2FLUOROPHENYL)METHYL)AMINO)THIANE4CARBOXAMIDE
O=C(N(C1(CCSCC1)C(=O)Nc1ccc(cc1)N(C)C)Cc1ccccc1F)CC1C(C1(C)C)c1c(C)(nH)c2c1cccc2
ZINC000008696052
ZINC000101386083

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Available files

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