Vitas-M small molecule compound

2-[(3-methylbenzyl)sulfanyl]-7-(3-nitrophenyl)[1,2,4]triazolo[1,5-a]pyrimidine

Catalog ID
STK231577
SMILES Cc1cccc(c1)CSc1nn2c(n1)nccc2c1cccc(c1)[N+](=O)[O-]

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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 C19H15N5O2S MW 377.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O2S/c1-13-4-2-5-14(10-13)12-27-19-21-18-20-9-8-17(23(18)22-19)15-6-3-7-16(11-15)24(25)26/h2-11H,12H2,1H3
InChIKey
HDOGNRBSIDCHQU-UHFFFAOYSA-N
Synonyms
879570-57-7
2((3methylbenzyl)sulfanyl)7(3nitrophenyl)(124)triazolo(15a)pyrimidine
2((3methylbenzyl)thio)7(3nitrophenyl)(124)triazolo(15a)pyrimidine
2((3METHYLPHENYL)METHYLSULFANYL)7(3NITROPHENYL)(124)TRIAZOLO(15A)PYRIMIDINE
2((3METHYLPHENYL)METHYLTHIO)7(3NITROPHENYL)8HYDRO124TRIAZOLO(15A)PYRIMIDINE
879570577
CC1=CC(=CC=C1)CSC2=NN3C(=CC=NC3=N2)C4=CC(=CC=C4)(N+)(=O)(O)
Cc1cccc(c1)CSc1nn2c(n1)nccc2c1cccc(c1)(N+)(=O)(O)
InChI=1SC19H15N5O2Sc11342514(1013)1227192118209817(23(18)2219)1563716(1115)24(25)26h211H12H21H3
MFCD07181728
ZINC000004736760
ZINC04736760
ZINC4736760

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Available files

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