Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[5-chloro-2-(naphthalen-1-ylmethoxy)phenyl]methylidene}-5-(piperidin-1-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK545180
SMILES Clc1ccc(c(c1)/C=N/NC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N)OCc1cccc2c1cccc2

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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 C29H28ClN9O3 MW 586.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN9O3/c30-22-11-12-25(41-18-20-9-6-8-19-7-2-3-10-23(19)20)21(15-22)16-32-34-29(40)26-24(17-38-13-4-1-5-14-38)39(37-33-26)28-27(31)35-42-36-28/h2-3,6-12,15-16H,1,4-5,13-14,17-18H2,(H2,31,35)(H,34,40)/b32-16+
InChIKey
HYRDCLDSZKFATM-KPGMTVGESA-N
Synonyms

(E)1(4amino125oxadiazol3yl)N(5chloro2(naphthalen1ylmethoxy)benzylidene)5(piperidin1ylmethyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(5chloro2(naphthalen1ylmethoxy)phenyl)methylidene)5(piperidin1ylmethyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(5CHLORO2(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENEAMINO)5(PIPERIDIN1YLMETHYL)TRIAZOLE4CARBOXAMIDE
C1CCN(CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=C(C=CC(=C4)Cl)OCC5=CC=CC6=CC=CC=C65
Clc1ccc(c(c1)C=NNC(=O)c1nnn(c1CN1CCCCC1)c1nonc1N)OCc1cccc2c1cccc2
InChI=1SC29H28ClN9O3c3022111225(411820968197231023(19)20)21(1522)16323429(40)2624(1738134151438)39(373326)2827(31)35423628h236121516H14513141718H2(H23135)(H3440)b3216+
MFCD03302283
ZINC000001845653
ZINC102440689

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Available files

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