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-diphenylpropanamide
Catalog ID
STK935058
SMILES COc1ccc(cc1)n1c(SC(C(=O)N(c2ccccc2)c2ccccc2)C)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 C38H35N3O3S MW 613.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H35N3O3S/c1-26(35(42)40(28-14-5-3-6-15-28)29-16-7-4-8-17-29)45-37-39-34-32-18-10-9-13-27(32)25-38(23-11-12-24-38)33(34)36(43)41(37)30-19-21-31(44-2)22-20-30/h3-10,13-22,26H,11-12,23-25H2,1-2H3InChIKey
IZQNOXCHSREAHL-UHFFFAOYSA-NSynonyms
2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)sulfanyl)NNdiphenylpropanamide
2((3(4methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclopentan)2yl)thio)NNdiphenylpropanamide
2(3(4METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOPENTANE)2YL)SULFANYLNNDIPHENYLPROPANAMIDE
CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=C(C(=O)N3C5=CC=C(C=C5)OC)C6(CCCC6)CC7=CC=CC=C74
InChI=1SC38H35N3O3Sc126(35(42)40(28145361528)29167481729)4537393432181091327(32)2538(2311122438)33(34)36(43)41(37)30192131(442)222030h310132226H11122325H212H3
MFCD04073393
ZINC000102835413
ZINC000102835414
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