Vitas-M small molecule compound
N-(2-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)tryptophan
Catalog ID
STL344623
SMILES OC(=O)C(Cc1c[nH]c2c1cccc2)Nc1nc(C)nc2c1c1CCCCc1s2
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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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c1-12-24-20(19-15-7-3-5-9-18(15)29-21(19)25-12)26-17(22(27)28)10-13-11-23-16-8-4-2-6-14(13)16/h2,4,6,8,11,17,23H,3,5,7,9-10H2,1H3,(H,27,28)(H,24,25,26)InChIKey
GHPGQQCSHRWMSS-UHFFFAOYSA-NSynonyms
(S)3(1Hindol3yl)2((2methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidin4yl)amino)propanoicacid
3(1Hindol3yl)2((2methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4yl)amino)propanoicacid
CC1=NC(=C2C3=C(CCCC3)SC2=N1)NC(CC4=CNC5=CC=CC=C54)C(=O)O
InChI=1SC22H22N4O2Sc1122420(1915735918(15)2921(19)2512)2617(22(27)28)1013112316842614(13)16h2468111723H357910H21H3(H2728)(H242526)
MFCD03715786
N(2methyl5678tetrahydro(1)benzothieno(23d)pyrimidin4yl)tryptophan
OC(=O)(C@H)(Cc1c(nH)c2c1cccc2)Nc1nc(C)nc2c1c1CCCCc1s2
OC(=O)C(Cc1c(nH)c2c1cccc2)Nc1nc(C)nc2c1c1CCCCc1s2
ZINC000001138948
ZINC000001138949
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