Vitas-M small molecule compound
N-(3-hydroxypropyl)-4-{[(4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}benzamide
Catalog ID
STL079543
SMILES OCCCNC(=O)c1ccc(cc1)CSc1[nH]c(=O)c2c(n1)sc1c2CCC1
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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 C20H21N3O3S2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O3S2/c24-10-2-9-21-17(25)13-7-5-12(6-8-13)11-27-20-22-18(26)16-14-3-1-4-15(14)28-19(16)23-20/h5-8,24H,1-4,9-11H2,(H,21,25)(H,22,23,26)InChIKey
JJKIJBUJTUDHFP-UHFFFAOYSA-NSynonyms
433700-37-9433700379
C1CC2=C(C1)SC3=C2C(=O)NC(=N3)SCC4=CC=C(C=C4)C(=O)NCCCO
InChI=1SC20H21N3O3S2c2410292117(25)137512(6813)1127202218(26)161431415(14)2819(16)2320h5824H14911H2(H2125)(H222326)
MFCD02970078
N(3hydroxypropyl)4(((4oxo3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)methyl)benzamide
N(3hydroxypropyl)4(((4oxo4567tetrahydro3Hcyclopenta(45)thieno(23d)pyrimidin2yl)thio)methyl)benzamide
N(3hydroxypropyl)4((1oxo2678tetrahydrocyclopenta(23)thieno(24b)pyrimidin3yl)sulfanylmethyl)benzamide
OCCCNC(=O)c1ccc(cc1)CSc1(nH)c(=O)c2c(n1)sc1c2CCC1
ZINC000009046288
ZINC09046288
ZINC9046288
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