Vitas-M small molecule compound
2-[(3-chlorobenzyl)sulfanyl]-3-(pyridin-4-ylmethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK444046
SMILES Clc1cccc(c1)CSc1nc2sc3c(c2c(=O)n1Cc1ccncc1)CCCC3
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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 C23H20ClN3OS2 MW 454.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN3OS2/c24-17-5-3-4-16(12-17)14-29-23-26-21-20(18-6-1-2-7-19(18)30-21)22(28)27(23)13-15-8-10-25-11-9-15/h3-5,8-12H,1-2,6-7,13-14H2InChIKey
KINLIQACVCHDFN-UHFFFAOYSA-NSynonyms
2((3chlorobenzyl)sulfanyl)3(pyridin4ylmethyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((3chlorophenyl)methylsulfanyl)3(pyridin4ylmethyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)CC4=CC=NC=C4)SCC5=CC(=CC=C5)Cl
InChI=1SC23H20ClN3OS2c241753416(1217)142923262120(18612719(18)3021)22(28)27(23)13158102511915h35812H12671314H2
MFCD04055241
ZINC000020437330
ZINC20437330
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