Vitas-M small molecule compound
N-(5-chloro-2-methylphenyl)-2-[(4-oxo-3-propyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetamide
Catalog ID
STK556885
SMILES CCCn1c(SCC(=O)Nc2cc(Cl)ccc2C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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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 C29H32ClN3O2S MW 522.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32ClN3O2S/c1-3-15-33-27(35)25-26(22-10-6-5-9-20(22)17-29(25)13-7-4-8-14-29)32-28(33)36-18-24(34)31-23-16-21(30)12-11-19(23)2/h5-6,9-12,16H,3-4,7-8,13-15,17-18H2,1-2H3,(H,31,34)InChIKey
AFWVXWDBCUIRJM-UHFFFAOYSA-NSynonyms
573948-55-7573948557
CCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)NC5=C(C=CC(=C5)Cl)C
InChI=1SC29H32ClN3O2Sc13153327(35)2526(221065920(22)1729(25)137481429)3228(33)361824(34)31231621(30)121119(23)2h5691216H347813151718H212H3(H3134)
MFCD04021195
N(5chloro2methylphenyl)2((4oxo3propyl46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(5chloro2methylphenyl)2((4oxo3propyl46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
N(5CHLORO2METHYLPHENYL)2(4OXO3PROPYLSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000008738739
ZINC08738739
ZINC8738739
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