Vitas-M small molecule compound
3-(4-chlorobenzyl)-2-sulfanyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK435836
SMILES Clc1ccc(cc1)Cn1c(S)nc2c(c1=O)c1CCCc1s2
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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 C16H13ClN2OS2 MW 348.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2OS2/c17-10-6-4-9(5-7-10)8-19-15(20)13-11-2-1-3-12(11)22-14(13)18-16(19)21/h4-7H,1-3,8H2,(H,18,21)InChIKey
ATCMLEZLXPDJGU-UHFFFAOYSA-NSynonyms
2((4chlorophenyl)methyl)3sulfanylidene4678tetrahydrocyclopenta(23)thieno(24b)pyrimidin1one
3(4chlorobenzyl)2sulfanyl3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
C1CC2=C(C1)SC3=C2C(=O)N(C(=S)N3)CC4=CC=C(C=C4)Cl
InChI=1SC16H13ClN2OS2c1710649(5710)81915(20)131121312(11)2214(13)1816(19)21h47H138H2(H1821)
MFCD03944055
ZINC000017072480
ZINC17072480
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