Vitas-M small molecule compound

N-{(2R)-1-[(4-ethoxyphenyl)amino]-1-oxopropan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide

Catalog ID
STK632538
SMILES CCOc1ccc(cc1)NC(=O)[C@H](NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)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 C24H31N3O5S MW 473.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O5S/c1-4-32-21-9-7-20(8-10-21)26-23(28)18(3)25-24(29)19-13-15-27(16-14-19)33(30,31)22-11-5-17(2)6-12-22/h5-12,18-19H,4,13-16H2,1-3H3,(H,25,29)(H,26,28)/t18-/m1/s1
InChIKey
QWEQDUCSSVXZAF-GOSISDBHSA-N
Synonyms

(S)N(1((4ethoxyphenyl)amino)1oxopropan2yl)1tosylpiperidine4carboxamide
CCOC1=CC=C(C=C1)NC(=O)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C
CCOc1ccc(cc1)NC(=O)(C@@H)(NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C
CCOc1ccc(cc1)NC(=O)(C@H)(NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)C)C
InChI=1SC24H31N3O5Sc1432219720(81021)2623(28)18(3)2524(29)19131527(161419)33(3031)2211517(2)61222h5121819H41316H213H3(H2529)(H2628)t18m1s1
MFCD18159809
N((2R)1((4ethoxyphenyl)amino)1oxopropan2yl)1((4methylphenyl)sulfonyl)piperidine4carboxamide
N((2R)1(4ethoxyanilino)1oxopropan2yl)1(4methylphenyl)sulfonylpiperidine4carboxamide
ZINC000016033442
ZINC16033442

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Available files

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