Vitas-M small molecule compound

2-[(E)-2-(1-benzyl-2-methyl-1H-indol-3-yl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4(3H)-one

Catalog ID
STL048372
SMILES COc1ccc(cc1)n1c(/C=C/c2c3ccccc3n(c2C)Cc2ccccc2)nc2c(c1=O)cc(cc2)I

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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 C33H26IN3O2 MW 623.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26IN3O2/c1-22-27(28-10-6-7-11-31(28)36(22)21-23-8-4-3-5-9-23)17-19-32-35-30-18-12-24(34)20-29(30)33(38)37(32)25-13-15-26(39-2)16-14-25/h3-20H,21H2,1-2H3/b19-17+
InChIKey
RYNLZVHDNOPWJV-HTXNQAPBSA-N
Synonyms

(E)2(2(1benzyl2methyl1Hindol3yl)vinyl)6iodo3(4methoxyphenyl)quinazolin4(3H)one
2((E)2(1benzyl2methyl1Hindol3yl)ethenyl)6iodo3(4methoxyphenyl)quinazolin4(3H)one
2((E)2(1BENZYL2METHYLINDOL3YL)ETHENYL)6IODO3(4METHOXYPHENYL)QUINAZOLIN4ONE
CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C=CC4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=C(C=C6)OC
COc1ccc(cc1)n1c(C=Cc2c3ccccc3n(c2C)Cc2ccccc2)nc2c(c1=O)cc(cc2)I
InChI=1SC33H26IN3O2c12227(2810671131(28)36(22)21238435923)1719323530181224(34)2029(30)33(38)37(32)25131526(392)161425h320H21H212H3b1917+
MFCD05726300
ZINC000097969638
ZINC97969638

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Available files

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