Vitas-M small molecule compound
(5Z)-1-(4-chlorophenyl)-5-({2,5-dimethyl-1-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-1H-pyrrol-3-yl}methylidene)-3-ethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK195653
SMILES CCN1C(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)C23CC4CC(C3)CC(C2)C4)C)/C(=O)N(C1=S)c1ccc(cc1)Cl
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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 C35H36ClN3O2S MW 598.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H36ClN3O2S/c1-4-37-32(40)31(33(41)39(34(37)42)30-11-7-28(36)8-12-30)17-26-13-21(2)38(22(26)3)29-9-5-27(6-10-29)35-18-23-14-24(19-35)16-25(15-23)20-35/h5-13,17,23-25H,4,14-16,18-20H2,1-3H3/b31-17-InChIKey
SANHYTAIRCHDPF-LJUMEUDFSA-NSynonyms
(5Z)1(4chlorophenyl)5((25dimethyl1(4(tricyclo(3311~37~)dec1yl)phenyl)1Hpyrrol3yl)methylidene)3ethyl2thioxodihydropyrimidine46(1H5H)dione
(5Z)5((1(4(1ADAMANTYL)PHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1(4CHLOROPHENYL)3ETHYL2SULFANYLIDENE13DIAZINANE46DIONE
CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C)C(=O)N(C1=S)C7=CC=C(C=C7)Cl
CCN1C(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)C23CC4CC(C3)CC(C2)C4)C)C(=O)N(C1=S)c1ccc(cc1)Cl
InChI=1SC35H36ClN3O2Sc143732(40)31(33(41)39(34(37)42)3011728(36)81230)17261321(2)38(22(26)3)299527(61029)3518231424(1935)1625(1523)2035h513172325H414161820H213H3b3117
MFCD04319324
ZINC000097960937
ZINC97960937
Check stock
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Check stock on Vitas-MAvailable files
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