Vitas-M small molecule compound

2-(4-{N'-[({1-[(2-chlorophenoxy)methyl]-1H-pyrazol-3-yl}carbonyl)oxy]carbamimidoyl}phenoxy)acetamide

Catalog ID
STL399623
SMILES NC(=O)COc1ccc(cc1)/C(=N/OC(=O)c1ccn(n1)COc1ccccc1Cl)/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 C20H18ClN5O5 MW 443.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN5O5/c21-15-3-1-2-4-17(15)30-12-26-10-9-16(24-26)20(28)31-25-19(23)13-5-7-14(8-6-13)29-11-18(22)27/h1-10H,11-12H2,(H2,22,27)(H2,23,25)
InChIKey
DQWZWBKPZWLDMQ-UHFFFAOYSA-N
Synonyms
1005688-46-9
((E)(amino(4(2amino2oxoethoxy)phenyl)methylidene)amino)1((2chlorophenoxy)methyl)pyrazole3carboxylate
1005688469
2(4(N(((1((2CHLOROPHENOXY)METHYL)1HPYRAZOL3YL)CARBONYL)OXY)CARBAMIMIDOYL)PHENOXY)ACETAMIDE
C1=CC=C(C(=C1)OCN2C=CC(=N2)C(=O)ON=C(C3=CC=C(C=C3)OCC(=O)N)N)Cl
InChI=1SC20H18ClN5O5c2115312417(15)30122610916(2426)20(28)312519(23)135714(8613)291118(22)27h110H1112H2(H22227)(H22325)
MFCD04135982
NC(=O)COc1ccc(cc1)C(=NOC(=O)c1ccn(n1)COc1ccccc1Cl)N
ZINC000019639296
ZINC19639296

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Available files

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