Vitas-M small molecule compound
2-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide
Catalog ID
STK542860
SMILES O=C(Nc1cccc2c1cccc2)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 C36H33N3O2S MW 571.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H33N3O2S/c1-24-12-3-8-19-30(24)39-34(41)32-33(28-17-7-5-14-26(28)22-36(32)20-9-2-10-21-36)38-35(39)42-23-31(40)37-29-18-11-15-25-13-4-6-16-27(25)29/h3-8,11-19H,2,9-10,20-23H2,1H3,(H,37,40)InChIKey
IUAROEZFTCJZGW-UHFFFAOYSA-NSynonyms
2((3(2methylphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(naphthalen1yl)acetamide
2(3(2METHYLPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLNNAPHTHALEN1YLACETAMIDE
CC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC6=CC=CC7=CC=CC=C76
InChI=1SC36H33N3O2Sc12412381930(24)3934(41)3233(2817751426(28)2236(32)2092102136)3835(39)422331(40)37291811152513461627(25)29h381119H29102023H21H3(H3740)
MFCD03293363
N(naphthalen1yl)2((4oxo3(otolyl)46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
ZINC000001834990
ZINC01834990
ZINC1834990
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