Vitas-M small molecule compound

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

Catalog ID
STK547832
SMILES O=C(N(c1ccccc1)c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3

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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 C37H33N3O2S MW 583.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H33N3O2S/c1-26-14-8-11-21-31(26)40-35(42)33-34(30-20-10-9-15-27(30)24-37(33)22-12-13-23-37)38-36(40)43-25-32(41)39(28-16-4-2-5-17-28)29-18-6-3-7-19-29/h2-11,14-21H,12-13,22-25H2,1H3
InChIKey
HYORHTCBQLGNJM-UHFFFAOYSA-N
Synonyms

2((3(2methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)NNdiphenylacetamide
2((4oxo3(otolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)NNdiphenylacetamide
2(3(2METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLNNDIPHENYLACETAMIDE
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCC5)N=C2SCC(=O)N(C6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC37H33N3O2Sc126148112131(26)4035(42)3334(30201091527(30)2437(33)2212132337)3836(40)432532(41)39(28164251728)29186371929h2111421H12132225H21H3
MFCD03286850
ZINC000002593958
ZINC2593958

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Available files

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