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-(3-methylphenyl)acetamide
Catalog ID
STK938375
SMILES O=C(Nc1cccc(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)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 C33H33N3O2S MW 535.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O2S/c1-23-11-10-15-26(19-23)34-28(37)22-39-32-35-30-27-16-7-6-14-25(27)20-33(17-8-3-9-18-33)29(30)31(38)36(32)21-24-12-4-2-5-13-24/h2,4-7,10-16,19H,3,8-9,17-18,20-22H2,1H3,(H,34,37)InChIKey
DNCIQTOFENKBIJ-UHFFFAOYSA-NSynonyms
488726-02-92((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(3methylphenyl)acetamide
2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(mtolyl)acetamide
2(3BENZYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(3METHYLPHENYL)ACETAMIDE
488726029
CC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC33H33N3O2Sc12311101526(1923)3428(37)22393235302716761425(27)2033(178391833)29(30)31(38)36(32)2124124251324h247101619H38917182022H21H3(H3437)
MFCD03291585
ZINC000001800516
ZINC01800516
ZINC1800516
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