Vitas-M small molecule compound

ethyl 4-[4-(phenylcarbonyl)piperazin-1-yl]-3-({[4-(propan-2-yl)phenyl]carbonyl}amino)benzoate

Catalog ID
STK188989
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1)C(C)C)N1CCN(CC1)C(=O)c1ccccc1

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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 C30H33N3O4 MW 499.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O4/c1-4-37-30(36)25-14-15-27(26(20-25)31-28(34)23-12-10-22(11-13-23)21(2)3)32-16-18-33(19-17-32)29(35)24-8-6-5-7-9-24/h5-15,20-21H,4,16-19H2,1-3H3,(H,31,34)
InChIKey
QPHXJDDAKLECTA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)C(C)C
ETHYL4(4(PHENYLCARBONYL)PIPERAZIN1YL)3(((4(PROPAN2YL)PHENYL)CARBONYL)AMINO)BENZOATE
ETHYL4(4BENZOYLPIPERAZIN1YL)3((4PROPAN2YLBENZOYL)AMINO)BENZOATE
InChI=1SC30H33N3O4c143730(36)25141527(26(2025)3128(34)23121022(111323)21(2)3)32161833(191732)29(35)248657924h5152021H41619H213H3(H3134)
MFCD06665080
ZINC000009907939
ZINC09907939
ZINC9907939

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Available files

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