Vitas-M small molecule compound
propan-2-yl 2-chloro-5-(5-{(E)-[2-(1H-tetrazol-5-yl)hydrazinylidene]methyl}furan-2-yl)benzoate
Catalog ID
STK968395
SMILES CC(OC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=N/Nc1nnn[nH]1)C
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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 C16H15ClN6O3 MW 374.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN6O3/c1-9(2)25-15(24)12-7-10(3-5-13(12)17)14-6-4-11(26-14)8-18-19-16-20-22-23-21-16/h3-9H,1-2H3,(H2,19,20,21,22,23)/b18-8+InChIKey
RJZWSYAOSSUQNP-QGMBQPNBSA-NSynonyms
CC(C)OC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=NNC3=NNN=N3)Cl
CC(OC(=O)c1cc(ccc1Cl)c1ccc(o1)C=NNc1nnn(nH)1)C
InChI=1SC16H15ClN6O3c19(2)2515(24)12710(3513(12)17)146411(2614)81819162022232116h39H12H3(H21920212223)b188+
MFCD01157212
propan2yl2chloro5(5((E)(2(1Htetrazol5yl)hydrazinylidene)methyl)furan2yl)benzoate
propan2yl2chloro5(5((E)(2Htetrazol5ylhydrazinylidene)methyl)furan2yl)benzoate
ZINC000005381330
ZINC96577404
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