Vitas-M small molecule compound

4-[(E)-(2-carbamoylhydrazinylidene)methyl]-2-methoxyphenyl 4-methylbenzoate

Catalog ID
STK977213
SMILES COc1cc(/C=N/NC(=O)N)ccc1OC(=O)c1ccc(cc1)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 C17H17N3O4 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O4/c1-11-3-6-13(7-4-11)16(21)24-14-8-5-12(9-15(14)23-2)10-19-20-17(18)22/h3-10H,1-2H3,(H3,18,20,22)/b19-10+
InChIKey
XDIXFEDCGKCIBL-VXLYETTFSA-N
Synonyms
494756-31-9
(4((E)(CARBAMOYLHYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)4METHYLBENZOATE
4((E)(2carbamoylhydrazinylidene)methyl)2methoxyphenyl4methylbenzoate
4(2(AMINOCARBONYL)CARBOHYDRAZONOYL)2METHOXYPHENYL4METHYLBENZOATE
494756319
CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)N)OC
COc1cc(C=NNC(=O)N)ccc1OC(=O)c1ccc(cc1)C
InChI=1SC17H17N3O4c1113613(7411)16(21)24148512(915(14)232)10192017(18)22h310H12H3(H3182022)b1910+
MFCD02605399
ZINC000000478794
ZINC33317360

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Available files

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