Vitas-M small molecule compound

methyl 1-[(2-{[(3,4,5-trimethoxyphenyl)carbonyl]amino}phenyl)sulfonyl]prolinate

Catalog ID
STK781950
SMILES COC(=O)C1CCCN1S(=O)(=O)c1ccccc1NC(=O)c1cc(OC)c(c(c1)OC)OC

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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 C22H26N2O8S MW 478.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O8S/c1-29-17-12-14(13-18(30-2)20(17)31-3)21(25)23-15-8-5-6-10-19(15)33(27,28)24-11-7-9-16(24)22(26)32-4/h5-6,8,10,12-13,16H,7,9,11H2,1-4H3,(H,23,25)
InChIKey
MRMGVJVYQGAIEB-UHFFFAOYSA-N
Synonyms

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC=C2S(=O)(=O)N3CCCC3C(=O)OC
InChI=1SC22H26N2O8Sc129171214(1318(302)20(17)313)21(25)23158561019(15)33(2728)24117916(24)22(26)324h56810121316H7911H214H3(H2325)
methyl1((2(((345trimethoxyphenyl)carbonyl)amino)phenyl)sulfonyl)prolinate
METHYL1((2((345TRIMETHOXYBENZOYL)AMINO)PHENYL)SULFONYL)PROLINATE
METHYL1(2((345TRIMETHOXYBENZOYL)AMINO)PHENYL)SULFONYLPYRROLIDINE2CARBOXYLATE
MFCD06016235
ZINC000012418575
ZINC000013132389

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Available files

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