Vitas-M small molecule compound
4-[(1-phenyl-1H-1,2,4-triazol-5-yl)sulfanyl]but-2-yn-1-yl 4-chlorobenzoate
Catalog ID
STK205646
SMILES Clc1ccc(cc1)C(=O)OCC#CCSc1ncnn1c1ccccc1
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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 C19H14ClN3O2S MW 383.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClN3O2S/c20-16-10-8-15(9-11-16)18(24)25-12-4-5-13-26-19-21-14-22-23(19)17-6-2-1-3-7-17/h1-3,6-11,14H,12-13H2InChIKey
KKBNHGRAFQDZAH-UHFFFAOYSA-NSynonyms
4((1PHENYL1H124TRIAZOL5YL)SULFANYL)2BUTYNYL4CHLOROBENZOATE
4((1PHENYL1H124TRIAZOL5YL)SULFANYL)BUT2YN1YL4CHLOROBENZOATE
4((2PHENYL124TRIAZOL3YL)SULFANYL)BUT2YNYL4CHLOROBENZOATE
C1=CC=C(C=C1)N2C(=NC=N2)SCC#CCOC(=O)C3=CC=C(C=C3)Cl
InChI=1SC19H14ClN3O2Sc201610815(91116)18(24)25124513261921142223(19)176213717h1361114H1213H2
MFCD04390644
ZINC000004740870
ZINC04740870
ZINC4740870
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