Vitas-M small molecule compound

N-{5-[3-(1H-indol-3-yl)propyl]-1H-1,2,4-triazol-3-yl}-4-methoxybenzamide

Catalog ID
STL476465
SMILES COc1ccc(cc1)C(=O)Nc1n[nH]c(n1)CCCc1c[nH]c2c1cccc2

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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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-28-16-11-9-14(10-12-16)20(27)24-21-23-19(25-26-21)8-4-5-15-13-22-18-7-3-2-6-17(15)18/h2-3,6-7,9-13,22H,4-5,8H2,1H3,(H2,23,24,25,26,27)
InChIKey
XPJIMYUDKOBSTJ-UHFFFAOYSA-N
Synonyms
1676073-97-4
1676073974
COC1=CC=C(C=C1)C(=O)NC2=NNC(=N2)CCCC3=CNC4=CC=CC=C43
COc1ccc(cc1)C(=O)Nc1n(nH)c(n1)CCCc1c(nH)c2c1cccc2
InChI=1SC21H21N5O2c1281611914(101216)20(27)24212319(252621)84515132218732617(15)18h236791322H458H21H3(H22324252627)
MFCD28986518
N(5(3(1Hindol3yl)propyl)1H124triazol3yl)4methoxybenzamide
ZINC000170625714
ZINC170625714

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Available files

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