Vitas-M small molecule compound
3-{[(3-amino-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]methyl}benzonitrile
Catalog ID
STL166976
SMILES N#Cc1cccc(c1)CSc1nc2ccccc2c(=O)n1N
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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 C16H12N4OS MW 308.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4OS/c17-9-11-4-3-5-12(8-11)10-22-16-19-14-7-2-1-6-13(14)15(21)20(16)18/h1-8H,10,18H2InChIKey
CXABQYRQQATZMB-UHFFFAOYSA-NSynonyms
3(((3amino4oxo34dihydroquinazolin2yl)sulfanyl)methyl)benzonitrile
3((3amino4oxoquinazolin2yl)sulfanylmethyl)benzonitrile
C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=CC(=C3)C#N)N
InChI=1SC16H12N4OSc1791143512(811)1022161914721613(14)15(21)20(16)18h18H1018H2
MFCD20749336
ZINC000071768791
ZINC71768791
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