Vitas-M small molecule compound

ethyl 4-(4-ethylpiperazin-1-yl)-3-{[(3-methoxynaphthalen-2-yl)carbonyl]amino}benzoate

Catalog ID
STK189158
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1cc2ccccc2cc1OC)N1CCN(CC1)CC

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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 C27H31N3O4 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4/c1-4-29-12-14-30(15-13-29)24-11-10-21(27(32)34-5-2)17-23(24)28-26(31)22-16-19-8-6-7-9-20(19)18-25(22)33-3/h6-11,16-18H,4-5,12-15H2,1-3H3,(H,28,31)
InChIKey
AWMABNLJPKJYFO-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC4=CC=CC=C4C=C3OC
ETHYL4(4ETHYLPIPERAZIN1YL)3(((3METHOXYNAPHTHALEN2YL)CARBONYL)AMINO)BENZOATE
ethyl4(4ethylpiperazin1yl)3((3methoxynaphthalene2carbonyl)amino)benzoate
InChI=1SC27H31N3O4c1429121430(151329)24111021(27(32)3452)1723(24)2826(31)221619867920(19)1825(22)333h6111618H451215H213H3(H2831)
MFCD06665239
ZINC000009908024
ZINC9908024

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.