Vitas-M small molecule compound
N-(3-chloro-4-methoxyphenyl)-2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Catalog ID
STL441055
SMILES COc1ccc(cc1Cl)NC(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
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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 C33H32ClN3O3S MW 586.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32ClN3O3S/c1-21-10-4-7-13-26(21)37-31(39)29-30(24-12-6-5-11-22(24)19-33(29)16-8-3-9-17-33)36-32(37)41-20-28(38)35-23-14-15-27(40-2)25(34)18-23/h4-7,10-15,18H,3,8-9,16-17,19-20H2,1-2H3,(H,35,38)InChIKey
QQJFLMDRGPSPCH-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC(=C(C=C6)OC)Cl
InChI=1SC33H32ClN3O3Sc12110471326(21)3731(39)2930(2412651122(24)1933(29)168391733)3632(37)412028(38)3523141527(402)25(34)1823h47101518H38916171920H212H3(H3538)
MFCD06243780
N(3chloro4methoxyphenyl)2((3(2methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
N(3CHLORO4METHOXYPHENYL)2(3(2METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000003771720
ZINC3771720
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