Vitas-M small molecule compound
2-{[(2E)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(cyclohexylmethyl)quinazolin-4(3H)-one
Catalog ID
STK539728
SMILES C/C(=C\CSc1nc2ccccc2c(=O)n1CC1CCCCC1)/Cl
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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 C19H23ClN2OS MW 362.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23ClN2OS/c1-14(20)11-12-24-19-21-17-10-6-5-9-16(17)18(23)22(19)13-15-7-3-2-4-8-15/h5-6,9-11,15H,2-4,7-8,12-13H2,1H3/b14-11+InChIKey
ZCYXRKNATFXZNM-SDNWHVSQSA-NSynonyms
383900-83-2(E)2((3chlorobut2en1yl)thio)3(cyclohexylmethyl)quinazolin4(3H)one
2(((2E)3chlorobut2en1yl)sulfanyl)3(cyclohexylmethyl)quinazolin4(3H)one
2((E)3CHLOROBUT2ENYL)SULFANYL3(CYCLOHEXYLMETHYL)QUINAZOLIN4ONE
383900832
CC(=CCSC1=NC2=CC=CC=C2C(=O)N1CC3CCCCC3)Cl
CC(=CCSc1nc2ccccc2c(=O)n1CC1CCCCC1)Cl
InChI=1SC19H23ClN2OSc114(20)1112241921171065916(17)18(23)22(19)13157324815h5691115H24781213H21H3b1411+
MFCD03283858
ZINC000004871881
ZINC04871881
ZINC4871881
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