Vitas-M small molecule compound
N,N-dibenzyl-N'-[3-cyano-4-(4-methoxyphenyl)-4H-benzo[h]chromen-2-yl]imidoformamide
Catalog ID
STK270684
SMILES COc1ccc(cc1)C1C(=C(/N=C/N(Cc2ccccc2)Cc2ccccc2)Oc2c1ccc1c2cccc1)C#N
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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 C36H29N3O2 MW 535.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H29N3O2/c1-40-30-19-16-29(17-20-30)34-32-21-18-28-14-8-9-15-31(28)35(32)41-36(33(34)22-37)38-25-39(23-26-10-4-2-5-11-26)24-27-12-6-3-7-13-27/h2-21,25,34H,23-24H2,1H3/b38-25+InChIKey
KXFORSBNWKDSPQ-XPGZBYHPSA-NSynonyms
844854-13-3(E)NNdibenzylN(3cyano4(4methoxyphenyl)4Hbenzo(h)chromen2yl)formimidamide
844854133
COC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N=CN(CC5=CC=CC=C5)CC6=CC=CC=C6
COc1ccc(cc1)C1C(=C(N=CN(Cc2ccccc2)Cc2ccccc2)Oc2c1ccc1c2cccc1)C#N
InChI=1SC36H29N3O2c14030191629(172030)343221182814891531(28)35(32)4136(33(34)2237)382539(2326104251126)2427126371327h2212534H2324H21H3b3825+
MFCD04164730
NNdibenzylN(3cyano4(4methoxyphenyl)4Hbenzo(h)chromen2yl)imidoformamide
NNdibenzylN(3cyano4(4methoxyphenyl)4Hbenzo(h)chromen2yl)methanimidamide
ZINC000101108378
ZINC000101108379
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