Vitas-M small molecule compound
N-(4-chlorophenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STK556218
SMILES COc1cccc(c1)n1c(SCC(=O)Nc2ccc(cc2)Cl)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 C32H30ClN3O3S MW 572.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30ClN3O3S/c1-39-25-10-7-9-24(18-25)36-30(38)28-29(26-11-4-3-8-21(26)19-32(28)16-5-2-6-17-32)35-31(36)40-20-27(37)34-23-14-12-22(33)13-15-23/h3-4,7-15,18H,2,5-6,16-17,19-20H2,1H3,(H,34,37)InChIKey
QUEMARFDSWBKGB-UHFFFAOYSA-NSynonyms
COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC=C(C=C6)Cl
InChI=1SC32H30ClN3O3Sc13925107924(1825)3630(38)2829(261143821(26)1932(28)165261732)3531(36)402027(37)3423141222(33)131523h3471518H25616171920H21H3(H3437)
MFCD04016445
N(4chlorophenyl)2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(4chlorophenyl)2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
N(4CHLOROPHENYL)2(3(3METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001790858
ZINC01790858
ZINC1790858
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