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-chloro-4-methoxyphenyl)acetamide
Catalog ID
STK556102
SMILES COc1ccc(cc1Cl)NC(=O)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 C33H32ClN3O3S MW 586.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32ClN3O3S/c1-40-27-15-14-24(18-26(27)34)35-28(38)21-41-32-36-30-25-13-7-6-12-23(25)19-33(16-8-3-9-17-33)29(30)31(39)37(32)20-22-10-4-2-5-11-22/h2,4-7,10-15,18H,3,8-9,16-17,19-21H2,1H3,(H,35,38)InChIKey
UJZOKSUCWWIKQR-UHFFFAOYSA-NSynonyms
2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)N(3chloro4methoxyphenyl)acetamide
2((3benzyl4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)N(3chloro4methoxyphenyl)acetamide
2(3BENZYL4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLN(3CHLORO4METHOXYPHENYL)ACETAMIDE
COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4)C5(CCCCC5)CC6=CC=CC=C63)Cl
InChI=1SC33H32ClN3O3Sc14027151424(1826(27)34)3528(38)21413236302513761223(25)1933(168391733)29(30)31(39)37(32)2022104251122h247101518H38916171921H21H3(H3538)
MFCD04015712
ZINC000001875672
ZINC01875672
ZINC1875672
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