Vitas-M small molecule compound
1-(6-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)-2-{[4-phenyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK737211
SMILES COc1ccc2c(c1)C(C)CC(N2C(=O)CSc1nnc(n1c1ccccc1)c1cccs1)(C)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 C27H28N4O2S2 MW 504.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O2S2/c1-18-16-27(2,3)31(22-13-12-20(33-4)15-21(18)22)24(32)17-35-26-29-28-25(23-11-8-14-34-23)30(26)19-9-6-5-7-10-19/h5-15,18H,16-17H2,1-4H3InChIKey
UIMBYKUOYLJZJG-UHFFFAOYSA-NSynonyms
1(6methoxy224trimethyl34dihydroquinolin1(2H)yl)2((4phenyl5(thiophen2yl)4H124triazol3yl)sulfanyl)ethanone
1(6METHOXY224TRIMETHYL34DIHYDROQUINOLIN1YL)2((4PHENYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ETHANONE
CC1CC(N(C2=C1C=C(C=C2)OC)C(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=CS5)(C)C
InChI=1SC27H28N4O2S2c1181627(23)31(22131220(334)1521(18)22)24(32)173526292825(23118143423)30(26)1996571019h51518H1617H214H3
MFCD05860227
ZINC000012417581
ZINC000012417584
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