Vitas-M small molecule compound

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

Catalog ID
STK930722
SMILES COc1ccc(cc1)n1c(SCC(=O)N(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCC1)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 C37H33N3O3S MW 599.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H33N3O3S/c1-43-30-20-18-29(19-21-30)40-35(42)33-34(31-17-9-8-12-26(31)24-37(33)22-10-11-23-37)38-36(40)44-25-32(41)39(27-13-4-2-5-14-27)28-15-6-3-7-16-28/h2-9,12-21H,10-11,22-25H2,1H3
InChIKey
CSTNVZCKJABPTK-UHFFFAOYSA-N
Synonyms

2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)NNdiphenylacetamide
2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)NNdiphenylacetamide
2(3(4METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLNNDIPHENYLACETAMIDE
COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC(=O)N(C6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC37H33N3O3Sc14330201829(192130)4035(42)3334(3117981226(31)2437(33)2210112337)3836(40)442532(41)39(27134251427)28156371628h291221H10112225H21H3
MFCD04082631
ZINC000001868064
ZINC01868064
ZINC1868064

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Available files

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