Vitas-M small molecule compound
methyl 4-{[({1-[4-(trifluoromethoxy)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK773027
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnnn1c1ccc(cc1)OC(F)(F)F
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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 C18H14F3N5O4S MW 453.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14F3N5O4S/c1-29-16(28)11-2-4-12(5-3-11)22-15(27)10-31-17-23-24-25-26(17)13-6-8-14(9-7-13)30-18(19,20)21/h2-9H,10H2,1H3,(H,22,27)InChIKey
FKLQDPNEIRJJFE-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=NN2C3=CC=C(C=C3)OC(F)(F)F
InChI=1SC18H14F3N5O4Sc12916(28)112412(5311)2215(27)10311723242526(17)136814(9713)3018(1920)21h29H10H21H3(H2227)
methyl4((((1(4(trifluoromethoxy)phenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2(1(4(TRIFLUOROMETHOXY)PHENYL)TETRAZOL5YL)SULFANYLACETYL)AMINO)BENZOATE
MFCD03821140
ZINC000001079675
ZINC01079675
ZINC1079675
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Check stock on Vitas-MAvailable files
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