Vitas-M small molecule compound
ethyl 4-methyl-2-[({[4-methyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-1,3-thiazole-5-carboxylate
Catalog ID
STK469716
SMILES CCOC(=O)c1sc(nc1C)NC(=O)CSc1nnc(n1C)c1csc2c1CCCC2
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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 C20H23N5O3S3 MW 477.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N5O3S3/c1-4-28-18(27)16-11(2)21-19(31-16)22-15(26)10-30-20-24-23-17(25(20)3)13-9-29-14-8-6-5-7-12(13)14/h9H,4-8,10H2,1-3H3,(H,21,22,26)InChIKey
ODODPSOXXLQOOE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C(S1)NC(=O)CSC2=NN=C(N2C)C3=CSC4=C3CCCC4)C
ethyl4methyl2((((4methyl5(4567tetrahydro1benzothiophen3yl)4H124triazol3yl)sulfanyl)acetyl)amino)13thiazole5carboxylate
ethyl4methyl2((2((4methyl5(4567tetrahydro1benzothiophen3yl)124triazol3yl)sulfanyl)acetyl)amino)13thiazole5carboxylate
InChI=1SC20H23N5O3S3c142818(27)1611(2)2119(3116)2215(26)103020242317(25(20)3)1392914865712(13)14h9H4810H213H3(H212226)
MFCD07186211
ZINC000020168274
ZINC20168274
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