Vitas-M small molecule compound
3-amino-2-[(3,4-dimethylbenzyl)sulfanyl]-7-fluoroquinazolin-4(3H)-one
Catalog ID
STL143558
SMILES Fc1ccc2c(c1)nc(n(c2=O)N)SCc1ccc(c(c1)C)C
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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 C17H16FN3OS MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN3OS/c1-10-3-4-12(7-11(10)2)9-23-17-20-15-8-13(18)5-6-14(15)16(22)21(17)19/h3-8H,9,19H2,1-2H3InChIKey
LBOSNCBBKSKZRW-UHFFFAOYSA-NSynonyms
3amino2((34dimethylbenzyl)sulfanyl)7fluoroquinazolin4(3H)one
3amino2((34dimethylphenyl)methylsulfanyl)7fluoroquinazolin4one
CC1=C(C=C(C=C1)CSC2=NC3=C(C=CC(=C3)F)C(=O)N2N)C
InChI=1SC17H16FN3OSc1103412(711(10)2)923172015813(18)5614(15)16(22)21(17)19h38H919H212H3
MFCD20749388
ZINC000071327733
ZINC71327733
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