Vitas-M small molecule compound
2-[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]-N,N-diphenylpropanamide
Catalog ID
STK928218
SMILES O=C(N(c1ccccc1)c1ccccc1)C(Sc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3)C
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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 C39H37N3O2S MW 611.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H37N3O2S/c1-28(36(43)42(31-19-8-3-9-20-31)32-21-10-4-11-22-32)45-38-40-35-33-23-13-12-18-30(33)26-39(24-14-5-15-25-39)34(35)37(44)41(38)27-29-16-6-2-7-17-29/h2-4,6-13,16-23,28H,5,14-15,24-27H2,1H3InChIKey
HWBWGAPESDNBRJ-UHFFFAOYSA-NSynonyms
2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)NNdiphenylpropanamide
2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)NNdiphenylpropanamide
2(3BENZYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNDIPHENYLPROPANAMIDE
CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=C(C(=O)N3CC5=CC=CC=C5)C6(CCCCC6)CC7=CC=CC=C74
InChI=1SC39H37N3O2Sc128(36(43)42(31198392031)3221104112232)45384035332313121830(33)2639(24145152539)34(35)37(44)41(38)2729166271729h24613162328H514152427H21H3
MFCD04071978
ZINC000102383651
ZINC000102383653
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