Vitas-M small molecule compound
N-[(5-{[2-(cyclohexylamino)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-2-methoxybenzamide
Catalog ID
STK222157
SMILES COc1ccccc1C(=O)NCc1nnc(n1C)SCC(=O)NC1CCCCC1
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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 C20H27N5O3S MW 417.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O3S/c1-25-17(12-21-19(27)15-10-6-7-11-16(15)28-2)23-24-20(25)29-13-18(26)22-14-8-4-3-5-9-14/h6-7,10-11,14H,3-5,8-9,12-13H2,1-2H3,(H,21,27)(H,22,26)InChIKey
XXWGFTQHWIRFNS-UHFFFAOYSA-NSynonyms
CN1C(=NN=C1SCC(=O)NC2CCCCC2)CNC(=O)C3=CC=CC=C3OC
InChI=1SC20H27N5O3Sc12517(122119(27)1510671116(15)282)232420(25)291318(26)22148435914h67101114H35891213H212H3(H2127)(H2226)
MFCD07403221
N((5((2(cyclohexylamino)2oxoethyl)sulfanyl)4methyl4H124triazol3yl)methyl)2methoxybenzamide
N((5(2(CYCLOHEXYLAMINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)2METHOXYBENZAMIDE
N(5CYCLOHEXYLCARBAMOYLMETHYLSULFANYL4METHYL4H(124)TRIAZOL3YLMETHYL)2METHOXYBENZAMIDE
ZINC000006678003
ZINC06678003
ZINC6678003
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