Vitas-M small molecule compound
N-(4-bromophenyl)-2-[(3-phenyl-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl)sulfanyl]acetamide
Catalog ID
STL167317
SMILES O=C(Nc1ccc(cc1)Br)CSC1=NC2(N=C1c1ccccc1)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 C21H20BrN3OS MW 442.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrN3OS/c22-16-8-10-17(11-9-16)23-18(26)14-27-20-19(15-6-2-1-3-7-15)24-21(25-20)12-4-5-13-21/h1-3,6-11H,4-5,12-14H2,(H,23,26)InChIKey
HZBAWMBREPMTBW-UHFFFAOYSA-NSynonyms
899935-38-7899935387
C1CCC2(C1)N=C(C(=N2)SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4
InChI=1SC21H20BrN3OSc221681017(11916)2318(26)14272019(156213715)2421(2520)12451321h13611H451214H2(H2326)
MFCD14735800
N(4bromophenyl)2((2phenyl14diazaspiro(44)nona13dien3yl)sulfanyl)acetamide
N(4bromophenyl)2((3phenyl14diazaspiro(44)nona13dien2yl)sulfanyl)acetamide
ZINC000009599231
ZINC9599231
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