Vitas-M small molecule compound
2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N,N-diphenylpropanamide
Catalog ID
STL441041
SMILES COc1ccccc1n1c(SC(C(=O)N(c2ccccc2)c2ccccc2)C)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 C39H37N3O3S MW 627.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H37N3O3S/c1-27(36(43)41(29-17-6-3-7-18-29)30-19-8-4-9-20-30)46-38-40-35-31-21-11-10-16-28(31)26-39(24-14-5-15-25-39)34(35)37(44)42(38)32-22-12-13-23-33(32)45-2/h3-4,6-13,16-23,27H,5,14-15,24-26H2,1-2H3InChIKey
MQEZSRPWMQJYCZ-UHFFFAOYSA-NSynonyms
2((3(2methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)NNdiphenylpropanamide
2(3(2METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNDIPHENYLPROPANAMIDE
CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=C(C(=O)N3C5=CC=CC=C5OC)C6(CCCCC6)CC7=CC=CC=C74
InChI=1SC39H37N3O3Sc127(36(43)41(29176371829)30198492030)46384035312111101628(31)2639(24145152539)34(35)37(44)42(38)322212132333(32)452h34613162327H514152426H212H3
MFCD06243766
ZINC000008769620
ZINC000008769625
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