Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-[(3-phenyl-1,4-diazaspiro[4.4]nona-1,3-dien-2-yl)sulfanyl]acetamide
Catalog ID
STL167326
SMILES O=C(Nc1ccc2c(c1)OCO2)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 C22H21N3O3S MW 407.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O3S/c26-19(23-16-8-9-17-18(12-16)28-14-27-17)13-29-21-20(15-6-2-1-3-7-15)24-22(25-21)10-4-5-11-22/h1-3,6-9,12H,4-5,10-11,13-14H2,(H,23,26)InChIKey
FFCRRMJWDPYNAF-UHFFFAOYSA-NSynonyms
C1CCC2(C1)N=C(C(=N2)SCC(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5
InChI=1SC22H21N3O3Sc2619(2316891718(1216)28142717)13292120(156213715)2422(2521)10451122h136912H4510111314H2(H2326)
MFCD20750290
N(13benzodioxol5yl)2((2phenyl14diazaspiro(44)nona13dien3yl)sulfanyl)acetamide
N(13benzodioxol5yl)2((3phenyl14diazaspiro(44)nona13dien2yl)sulfanyl)acetamide
ZINC000071769090
ZINC71769090
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