Vitas-M small molecule compound
N-{[5-({2-[(4-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}-2-methoxybenzamide
Catalog ID
STK221550
SMILES COc1ccccc1C(=O)NCc1nnc(n1C)SCC(=O)Nc1ccc(cc1)Cl
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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 C20H20ClN5O3S MW 445.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O3S/c1-26-17(11-22-19(28)15-5-3-4-6-16(15)29-2)24-25-20(26)30-12-18(27)23-14-9-7-13(21)8-10-14/h3-10H,11-12H2,1-2H3,(H,22,28)(H,23,27)InChIKey
YFGWRHASOHKAEP-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)Cl)CNC(=O)C3=CC=CC=C3OC
InChI=1SC20H20ClN5O3Sc12617(112219(28)15534616(15)292)242520(26)301218(27)23149713(21)81014h310H1112H212H3(H2228)(H2327)
MFCD07403219
N((5((2((4CHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)2METHOXYBENZAMIDE
N((5(2(4CHLOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)2METHOXYBENZAMIDE
ZINC000009262788
ZINC09262788
ZINC9262788
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