Vitas-M small molecule compound
methyl 4-{3-[(N-ethyl-N'-phenylcarbamimidoyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoate
Catalog ID
STK759654
SMILES CCN/C(=N\c1ccccc1)/SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-3-22-21(23-15-7-5-4-6-8-15)29-17-13-18(25)24(19(17)26)16-11-9-14(10-12-16)20(27)28-2/h4-12,17H,3,13H2,1-2H3,(H,22,23)InChIKey
XNMLFCLAKMVGRY-UHFFFAOYSA-NSynonyms
CCN=C(NC1=CC=CC=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC
CCNC(=Nc1ccccc1)SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)OC
InChI=1SC21H21N3O4Sc132221(23157546815)29171318(25)24(19(17)26)1611914(101216)20(27)282h41217H313H212H3(H2223)
methyl4(3((NethylNphenylcarbamimidoyl)sulfanyl)25dioxopyrrolidin1yl)benzoate
METHYL4(3(NETHYLNPHENYLCARBAMIMIDOYL)SULFANYL25DIOXOPYRROLIDIN1YL)BENZOATE
MFCD01572416
ZINC000004523819
ZINC000100074661
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