Vitas-M small molecule compound
N-[5-(2,6-dichlorobenzyl)-1,3-thiazol-2-yl]-2-{[4-(prop-2-en-1-yl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL481875
SMILES C=CCn1c(SCC(=O)Nc2ncc(s2)Cc2c(Cl)cccc2Cl)nnc1c1csc2c1CCCC2
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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 C25H23Cl2N5OS3 MW 576.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23Cl2N5OS3/c1-2-10-32-23(18-13-34-21-9-4-3-6-16(18)21)30-31-25(32)35-14-22(33)29-24-28-12-15(36-24)11-17-19(26)7-5-8-20(17)27/h2,5,7-8,12-13H,1,3-4,6,9-11,14H2,(H,28,29,33)InChIKey
IXQXCVADJNDXDV-UHFFFAOYSA-NSynonyms
C=CCN1C(=NN=C1SCC(=O)NC2=NC=C(S2)CC3=C(C=CC=C3Cl)Cl)C4=CSC5=C4CCCC5
InChI=1SC25H23Cl2N5OS3c12103223(18133421943616(18)21)303125(32)351422(33)2924281215(3624)111719(26)75820(17)27h25781213H134691114H2(H282933)
MFCD06643491
N(5((26dichlorophenyl)methyl)13thiazol2yl)2((4prop2enyl5(4567tetrahydro1benzothiophen3yl)124triazol3yl)sulfanyl)acetamide
N(5(26dichlorobenzyl)13thiazol2yl)2((4(prop2en1yl)5(4567tetrahydro1benzothiophen3yl)4H124triazol3yl)sulfanyl)acetamide
ZINC000003764234
ZINC3764234
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