Vitas-M small molecule compound

N-(3-chlorophenyl)-2-{[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide

Catalog ID
STK557223
SMILES COc1cccc(c1)n1c(SCC(=O)Nc2cccc(c2)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/c1-39-25-13-8-12-24(18-25)36-30(38)28-29(26-14-4-3-9-21(26)19-32(28)15-5-2-6-16-32)35-31(36)40-20-27(37)34-23-11-7-10-22(33)17-23/h3-4,7-14,17-18H,2,5-6,15-16,19-20H2,1H3,(H,34,37)
InChIKey
OMGHCKZWEZOTHZ-UHFFFAOYSA-N
Synonyms

COC1=CC=CC(=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC(=CC=C6)Cl
InChI=1SC32H30ClN3O3Sc139251381224(1825)3630(38)2829(261443921(26)1932(28)155261632)3531(36)402027(37)34231171022(33)1723h347141718H25615161920H21H3(H3437)
MFCD04023660
N(3chlorophenyl)2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3chlorophenyl)2((3(3methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
N(3CHLOROPHENYL)2(3(3METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000001874561
ZINC01874561
ZINC1874561

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Available files

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