Vitas-M small molecule compound

5-(benzylsulfanyl)-2-phenyl[1,2,4]triazolo[1,5-c]quinazoline

Catalog ID
STK210773
SMILES c1ccc(cc1)CSc1nc2ccccc2c2n1nc(n2)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 C22H16N4S MW 368.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4S/c1-3-9-16(10-4-1)15-27-22-23-19-14-8-7-13-18(19)21-24-20(25-26(21)22)17-11-5-2-6-12-17/h1-14H,15H2
InChIKey
MRXKOMWBHYKSLS-UHFFFAOYSA-N
Synonyms

5(benzylsulfanyl)2phenyl(124)triazolo(15c)quinazoline
5BENZYLSULFANYL2PHENYL(124)TRIAZOLO(15C)QUINAZOLINE
9PHENYL6(PHENYLMETHYLTHIO)7HYDRO124TRIAZOLO(15C)QUINAZOLINE
C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C4=NC(=NN42)C5=CC=CC=C5
InChI=1SC22H16N4Sc13916(1041)152722231914871318(19)212420(2526(21)22)17115261217h114H15H2
MFCD06601793
ZINC000002229842
ZINC02229842
ZINC2229842

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.