Vitas-M small molecule compound
N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrol-2-yl]-3,4-dimethoxybenzamide
Catalog ID
STK991323
SMILES COc1cc(ccc1OC)C(=O)Nc1c(c2nc3c([nH]2)cccc3)c(c(n1CC1CCCO1)C)C
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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 C27H30N4O4 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O4/c1-16-17(2)31(15-19-8-7-13-35-19)26(24(16)25-28-20-9-5-6-10-21(20)29-25)30-27(32)18-11-12-22(33-3)23(14-18)34-4/h5-6,9-12,14,19H,7-8,13,15H2,1-4H3,(H,28,29)(H,30,32)InChIKey
PWNVTLIZISNFMU-UHFFFAOYSA-NSynonyms
CC1=C(N(C(=C1C2=NC3=CC=CC=C3N2)NC(=O)C4=CC(=C(C=C4)OC)OC)CC5CCCO5)C
InChI=1SC27H30N4O4c11617(2)31(151987133519)26(24(16)2528209561021(20)2925)3027(32)18111222(333)23(1418)344h569121419H781315H214H3(H2829)(H3032)
MFCD10040326
N(3(1Hbenzimidazol2yl)45dimethyl1(oxolan2ylmethyl)pyrrol2yl)34dimethoxybenzamide
N(3(1Hbenzimidazol2yl)45dimethyl1(tetrahydrofuran2ylmethyl)1Hpyrrol2yl)34dimethoxybenzamide
ZINC000011692102
ZINC000011692103
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