Vitas-M small molecule compound
3,4-dichloro-N-[(4-methyl-5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]benzamide
Catalog ID
STK232415
SMILES O=C(c1ccc(c(c1)Cl)Cl)NCc1nnc(n1C)SCc1nc2ccccc2c(=O)[nH]1
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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 C20H16Cl2N6O2S MW 475.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2N6O2S/c1-28-17(9-23-18(29)11-6-7-13(21)14(22)8-11)26-27-20(28)31-10-16-24-15-5-3-2-4-12(15)19(30)25-16/h2-8H,9-10H2,1H3,(H,23,29)(H,24,25,30)InChIKey
LDCWQFZJMJKFPB-UHFFFAOYSA-NSynonyms
34DICHLORON((4METHYL5(((4OXO34DIHYDROQUINAZOLIN2YL)METHYL)SULFANYL)4H124TRIAZOL3YL)METHYL)BENZAMIDE
34DICHLORON((4METHYL5((4OXO1HQUINAZOLIN2YL)METHYLSULFANYL)124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CNC(=O)C4=CC(=C(C=C4)Cl)Cl
InChI=1SC20H16Cl2N6O2Sc12817(92318(29)116713(21)14(22)811)262720(28)3110162415532412(15)19(30)2516h28H910H21H3(H2329)(H242530)
MFCD06627927
O=C(c1ccc(c(c1)Cl)Cl)NCc1nnc(n1C)SCc1nc2ccccc2c(=O)(nH)1
ZINC000009302501
ZINC09302501
ZINC9302501
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