Vitas-M small molecule compound

N-(diphenylmethyl)-2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide

Catalog ID
STK547076
SMILES COc1ccccc1n1c(SCC(=O)NC(c2ccccc2)c2ccccc2)nc2c(c1=O)C1(CCCCC1)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 C39H37N3O3S MW 627.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H37N3O3S/c1-45-32-22-12-11-21-31(32)42-37(44)34-36(30-20-10-9-19-29(30)25-39(34)23-13-4-14-24-39)41-38(42)46-26-33(43)40-35(27-15-5-2-6-16-27)28-17-7-3-8-18-28/h2-3,5-12,15-22,35H,4,13-14,23-26H2,1H3,(H,40,43)
InChIKey
JXLRYDFJPZQMBG-UHFFFAOYSA-N
Synonyms

COC1=CC=CC=C1N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N=C2SCC(=O)NC(C6=CC=CC=C6)C7=CC=CC=C7
InChI=1SC39H37N3O3Sc145322212112131(32)4237(44)3436(30201091929(30)2539(34)23134142439)4138(42)462633(43)4035(27155261627)28177381828h23512152235H413142326H21H3(H4043)
MFCD03290230
N(diphenylmethyl)2((3(2methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)sulfanyl)acetamide
Nbenzhydryl2((3(2methoxyphenyl)4oxo46dihydro3Hspiro(benzo(h)quinazoline51cyclohexan)2yl)thio)acetamide
NBENZHYDRYL2(3(2METHOXYPHENYL)4OXOSPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)2YL)SULFANYLACETAMIDE
ZINC000102446935
ZINC102446935

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Available files

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