Vitas-M small molecule compound
4-(3-{[N'-(4-fluorophenyl)-N-methylcarbamimidoyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Catalog ID
STL171949
SMILES CN/C(=N\c1ccc(cc1)F)/SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O
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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 C19H16FN3O4S MW 401.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16FN3O4S/c1-21-19(22-13-6-4-12(20)5-7-13)28-15-10-16(24)23(17(15)25)14-8-2-11(3-9-14)18(26)27/h2-9,15H,10H2,1H3,(H,21,22)(H,26,27)InChIKey
ZBKYBZIQQUOCHA-UHFFFAOYSA-NSynonyms
313380-72-2313380722
4(3((((4FLUOROPHENYL)IMINO)(METHYLAMINO)METHYL)SULFANYL)25DIOXO1PYRROLIDINYL)BENZOICACID
4(3(((4FLUOROPHENYL)(METHYL)CARBAMIMIDOYL)SULFANYL)25DIOXOPYRROLIDIN1YL)BENZOICACID
4(3((4FLUOROANILINO)METHYLAZANIUMYLIDENEMETHYL)SULFANYL25DIOXOPYRROLIDIN1YL)BENZOATE
4(3((E)(4fluoroanilino)methylazaniumylidenemethyl)sulfanyl25dioxopyrrolidin1yl)benzoate
4(3((N(4fluorophenyl)Nmethylcarbamimidoyl)sulfanyl)25dioxopyrrolidin1yl)benzoicacid
4(3(N(4FLUOROPHENYL)NMETHYLCARBAMIMIDOYL)SULFANYL25DIOXOPYRROLIDIN1YL)BENZOICACID
C(NH+)=C(NC1=CC=C(C=C1)F)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)(O)
CNC(=Nc1ccc(cc1)F)SC1CC(=O)N(C1=O)c1ccc(cc1)C(=O)O
InChI=1SC19H16FN3O4Sc12119(22136412(20)5713)28151016(24)23(17(15)25)148211(3914)18(26)27h2915H10H21H3(H2122)(H2627)
MFCD01450486
ZINC000006855055
ZINC000102437494
Check stock
See real-time availability and sample size for STL171949 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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