Vitas-M small molecule compound
methyl 2-({[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL334593
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc(N)c2c(n1)sc1c2CCCC1
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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 C20H20N4O3S2 MW 428.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3S2/c1-27-19(26)11-6-2-4-8-13(11)22-15(25)10-28-20-23-17(21)16-12-7-3-5-9-14(12)29-18(16)24-20/h2,4,6,8H,3,5,7,9-10H2,1H3,(H,22,25)(H2,21,23,24)InChIKey
XCUFSBYWVHMMML-UHFFFAOYSA-NSynonyms
489400-33-1489400331
COC(=O)C1=CC=CC=C1NC(=O)CSC2=NC(=C3C4=C(CCCC4)SC3=N2)N
InChI=1SC20H20N4O3S2c12719(26)11624813(11)2215(25)1028202317(21)1612735914(12)2918(16)2420h2468H357910H21H3(H2225)(H2212324)
methyl2((((4amino5678tetrahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((4amino5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2(2((4amino5678tetrahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamido)benzoate
MFCD03295847
ZINC000002248473
ZINC02248473
ZINC2248473
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