Vitas-M small molecule compound
3,4,5-trimethoxy-N-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]benzamide
Catalog ID
STK770314
SMILES COc1c(OC)cc(cc1OC)C(=O)Nc1ccc(cc1)c1nnc2n1CCCCC2
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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 C23H26N4O4 MW 422.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4/c1-29-18-13-16(14-19(30-2)21(18)31-3)23(28)24-17-10-8-15(9-11-17)22-26-25-20-7-5-4-6-12-27(20)22/h8-11,13-14H,4-7,12H2,1-3H3,(H,24,28)InChIKey
BQIWTMHCHWWWTR-UHFFFAOYSA-NSynonyms
345trimethoxyN(4(6789tetrahydro5H(124)triazolo(43a)azepin3yl)phenyl)benzamide
COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=C(C=C2)C3=NN=C4N3CCCCC4
InChI=1SC23H26N4O4c129181316(1419(302)21(18)313)23(28)241710815(91117)2226252075461227(20)22h8111314H4712H213H3(H2428)
MFCD03460730
ZINC000001072760
ZINC01072760
ZINC1072760
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