Vitas-M small molecule compound
methyl 4-({2-[(4-oxo-3,4,5,6,7,8-hexahydroquinazolin-2-yl)sulfanyl]propanoyl}amino)benzoate
Catalog ID
STK274536
SMILES COC(=O)c1ccc(cc1)NC(=O)C(Sc1nc2CCCCc2c(=O)[nH]1)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 C19H21N3O4S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4S/c1-11(16(23)20-13-9-7-12(8-10-13)18(25)26-2)27-19-21-15-6-4-3-5-14(15)17(24)22-19/h7-11H,3-6H2,1-2H3,(H,20,23)(H,21,22,24)InChIKey
COFNYQAQWICOLR-UHFFFAOYSA-NSynonyms
879062-39-2879062392
CC(C(=O)NC1=CC=C(C=C1)C(=O)OC)SC2=NC(=O)C3=C(N2)CCCC3
COC(=O)c1ccc(cc1)NC(=O)C(Sc1nc2CCCCc2c(=O)(nH)1)C
InChI=1SC19H21N3O4Sc111(16(23)20139712(81013)18(25)262)27192115643514(15)17(24)2219h711H36H212H3(H2023)(H212224)
methyl4((2((4oxo345678hexahydroquinazolin2yl)sulfanyl)propanoyl)amino)benzoate
methyl4(2((4oxo5678tetrahydro1Hquinazolin2yl)sulfanyl)propanoylamino)benzoate
MFCD07792543
ZINC000004999517
ZINC000004999518
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