Vitas-M small molecule compound
{[5-(2-bromophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STK052936
SMILES OC(=O)CSc1nnc(n1C1CCCCC1)c1ccccc1Br
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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 C16H18BrN3O2S MW 396.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN3O2S/c17-13-9-5-4-8-12(13)15-18-19-16(23-10-14(21)22)20(15)11-6-2-1-3-7-11/h4-5,8-9,11H,1-3,6-7,10H2,(H,21,22)InChIKey
ZJLMVVXKDHYAJJ-UHFFFAOYSA-NSynonyms
((5(2BROMOPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)ACETICACID
2((5(2BROMOPHENYL)4CYCLOHEXYL124TRIAZOL3YL)SULFANYL)ACETICACID
2(5(2BROMOPHENYL)4CYCLOHEXYL124TRIAZOL3YLTHIO)ACETICACID
C1CCC(CC1)N2C(=NN=C2SCC(=O)O)C3=CC=CC=C3Br
InChI=1SC16H18BrN3O2Sc1713954812(13)15181916(231014(21)22)20(15)116213711h458911H136710H2(H2122)
MFCD02375700
OC(=O)CSc1nnc(n1C1CCCCC1)c1ccccc1Br
STK052936
ZINC000004558351
ZINC4558351
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