Vitas-M small molecule compound
3-(3-{[{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Catalog ID
STK377114
SMILES N=C(SC1CC(=O)N(C1=O)c1cccc(c1)C(=O)O)N/N=C/c1ccc(cc1)N(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 C21H21N5O4S MW 439.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O4S/c1-25(2)15-8-6-13(7-9-15)12-23-24-21(22)31-17-11-18(27)26(19(17)28)16-5-3-4-14(10-16)20(29)30/h3-10,12,17H,11H2,1-2H3,(H2,22,24)(H,29,30)/b23-12+InChIKey
KXMOXSOZVRRMQX-FSJBWODESA-NSynonyms
3(3((((1E)2(4(DIMETHYLAMINO)PHENYL)1AZAVINYL)AMINO)IMINOMETHYLTHIO)25DIOXOAZOLIDINYL)BENZOICACID
3(3((((2E)2(4(dimethylamino)benzylidene)hydrazinyl)(imino)methyl)sulfanyl)25dioxopyrrolidin1yl)benzoicacid
3(3((E)N((E)(4(dimethylamino)phenyl)methylideneamino)carbamimidoyl)sulfanyl25dioxopyrrolidin1yl)benzoicacid
CN(C)C1=CC=C(C=C1)C=NN=C(N)SC2CC(=O)N(C2=O)C3=CC=CC(=C3)C(=O)O
InChI=1SC21H21N5O4Sc125(2)158613(7915)12232421(22)31171118(27)26(19(17)28)1653414(1016)20(29)30h3101217H11H212H3(H22224)(H2930)b2312+
MFCD00624533
N=C(SC1CC(=O)N(C1=O)c1cccc(c1)C(=O)O)NN=Cc1ccc(cc1)N(C)C
ZINC000022612123
ZINC000102128613
Check stock
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Check stock on Vitas-MAvailable files
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