Vitas-M small molecule compound
3-{[(3-amino-6-bromo-4-oxo-3,4-dihydroquinazolin-2-yl)sulfanyl]methyl}benzonitrile
Catalog ID
STL166956
SMILES N#Cc1cccc(c1)CSc1nc2ccc(cc2c(=O)n1N)Br
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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 C16H11BrN4OS MW 387.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN4OS/c17-12-4-5-14-13(7-12)15(22)21(19)16(20-14)23-9-11-3-1-2-10(6-11)8-18/h1-7H,9,19H2InChIKey
IZTUKOGSJVMINX-UHFFFAOYSA-NSynonyms
3(((3amino6bromo4oxo34dihydroquinazolin2yl)sulfanyl)methyl)benzonitrile
3((3amino6bromo4oxoquinazolin2yl)sulfanylmethyl)benzonitrile
C1=CC(=CC(=C1)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2N)C#N
InChI=1SC16H11BrN4OSc1712451413(712)15(22)21(19)16(2014)2391131210(611)818h17H919H2
MFCD20749302
ZINC000071768771
ZINC71768771
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