Vitas-M small molecule compound

6-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-2-[(4-methylquinazolin-2-yl)amino]pyrimidin-4-ol

Catalog ID
STK068245
SMILES Oc1cc(CSc2nc3c(s2)cccc3)nc(n1)Nc1nc(C)c2c(n1)cccc2

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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 C21H16N6OS2 MW 432.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N6OS2/c1-12-14-6-2-3-7-15(14)24-19(22-12)27-20-23-13(10-18(28)26-20)11-29-21-25-16-8-4-5-9-17(16)30-21/h2-10H,11H2,1H3,(H2,22,23,24,26,27,28)
InChIKey
BNZJPHJRYRCPBI-UHFFFAOYSA-N
Synonyms
373371-97-2
373371972
6((13BENZOTHIAZOL2YLSULFANYL)METHYL)2(((2Z)4METHYLQUINAZOLIN2(3H)YLIDENE)AMINO)PYRIMIDIN4(1H)ONE
6((13BENZOTHIAZOL2YLSULFANYL)METHYL)2((4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4(1H)ONE
6((13BENZOTHIAZOL2YLSULFANYL)METHYL)2((4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4(3H)ONE
6((13BENZOTHIAZOL2YLSULFANYL)METHYL)2((4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4OL
6((benzo(d)thiazol2ylthio)methyl)2((4methylquinazolin2yl)amino)pyrimidin4ol
6(13BENZOTHIAZOL2YLSULFANYLMETHYL)2((4METHYLQUINAZOLIN2YL)AMINO)1HPYRIMIDIN4ONE
6(BENZOTHIAZOL2YLTHIOMETHYL)2((4METHYLQUINAZOLIN2YL)AMINO)PYRIMIDIN4OL
CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CSC4=NC5=CC=CC=C5S4
InChI=1SC21H16N6OS2c11214623715(14)2419(2212)27202313(1018(28)2620)1129212516845917(16)3021h210H11H21H3(H2222324262728)
MFCD01946859
Oc1cc(CSc2nc3c(s2)cccc3)nc(n1)Nc1nc(C)c2c(n1)cccc2
STK068245
ZINC000008837384
ZINC08837384
ZINC8837384

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.