Vitas-M small molecule compound
2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Catalog ID
STK555213
SMILES COc1cccc(c1)n1c(SCC(=O)Nc2nccs2)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 C29H28N4O3S2 MW 544.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O3S2/c1-36-21-10-7-9-20(16-21)33-26(35)24-25(32-28(33)38-18-23(34)31-27-30-14-15-37-27)22-11-4-3-8-19(22)17-29(24)12-5-2-6-13-29/h3-4,7-11,14-16H,2,5-6,12-13,17-18H2,1H3,(H,30,31,34)InChIKey
SFVCATUELWEZEQ-UHFFFAOYSA-NSynonyms
840511-83-32((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(13thiazol2yl)acetamide
2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(thiazol2yl)acetamide
2(3(3METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(13THIAZOL2YL)ACETAMIDE
840511833
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=NC=CS6
InChI=1SC29H28N4O3S2c13621107920(1621)3326(35)2425(3228(33)381823(34)31273014153727)221143819(22)1729(24)125261329h347111416H25612131718H21H3(H303134)
MFCD04009620
ZINC000002265770
ZINC2265770
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