Vitas-M small molecule compound
2-(1,3-benzothiazol-2-ylamino)-7,7-dimethyl-4-(pyridin-3-yl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Catalog ID
STK217715
SMILES O=C1CC(C)(C)CC2=C1C(N=C(N2)Nc1nc2c(s1)cccc2)c1cccnc1
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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 C22H21N5OS MW 403.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5OS/c1-22(2)10-15-18(16(28)11-22)19(13-6-5-9-23-12-13)26-20(24-15)27-21-25-14-7-3-4-8-17(14)29-21/h3-9,12,19H,10-11H2,1-2H3,(H2,24,25,26,27)InChIKey
XGQDZOFQHOMEGP-UHFFFAOYSA-NSynonyms
777868-43-62(13benzothiazol2ylamino)77dimethyl4(pyridin3yl)4678tetrahydroquinazolin5(1H)one
2(13benzothiazol2ylamino)77dimethyl4pyridin3yl1468tetrahydroquinazolin5one
2(benzo(d)thiazol2ylamino)77dimethyl4(pyridin3yl)4678tetrahydroquinazolin5(1H)one
777868436
CC1(CC2=C(C(N=C(N2)NC3=NC4=CC=CC=C4S3)C5=CN=CC=C5)C(=O)C1)C
InChI=1SC22H21N5OSc122(2)101518(16(28)1122)19(13659231213)2620(2415)27212514734817(14)2921h391219H1011H212H3(H224252627)
MFCD06600681
ZINC000013003606
ZINC000013003615
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