Vitas-M small molecule compound
5-(azepan-1-yl)-3-(phenylsulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Catalog ID
STL107402
SMILES O=S(=O)(c1nnn2c1nc(N1CCCCCC1)c1c2cccc1)c1ccccc1
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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 C21H21N5O2S MW 407.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2S/c27-29(28,16-10-4-3-5-11-16)21-20-22-19(25-14-8-1-2-9-15-25)17-12-6-7-13-18(17)26(20)24-23-21/h3-7,10-13H,1-2,8-9,14-15H2InChIKey
BHTCYBHBHWCHAP-UHFFFAOYSA-NSynonyms
5(AZEPAN1YL)3(BENZENESULFONYL)TRIAZOLO(15A)QUINAZOLINE
5(azepan1yl)3(phenylsulfonyl)(123)triazolo(15a)quinazoline
C1CCCN(CC1)C2=NC3=C(N=NN3C4=CC=CC=C42)S(=O)(=O)C5=CC=CC=C5
InChI=1SC21H21N5O2Sc2729(2816104351116)21202219(251481291525)1712671318(17)26(20)242321h371013H12891415H2
MFCD05899755
ZINC000002690448
ZINC2690448
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