Vitas-M small molecule compound

methyl 2-({[5-(2-nitrophenyl)furan-2-yl]carbonyl}amino)-1,3-benzothiazole-6-carboxylate

Catalog ID
STK319751
SMILES COC(=O)c1ccc2c(c1)sc(n2)NC(=O)c1ccc(o1)c1ccccc1[N+](=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 C20H13N3O6S MW 423.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O6S/c1-28-19(25)11-6-7-13-17(10-11)30-20(21-13)22-18(24)16-9-8-15(29-16)12-4-2-3-5-14(12)23(26)27/h2-10H,1H3,(H,21,22,24)
InChIKey
ZRUWJTKWBWRRFI-UHFFFAOYSA-N
Synonyms
951937-79-4
951937794
COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC=C(O3)C4=CC=CC=C4(N+)(=O)(O)
COC(=O)c1ccc2c(c1)sc(n2)NC(=O)c1ccc(o1)c1ccccc1(N+)(=O)(O)
InChI=1SC20H13N3O6Sc12819(25)11671317(1011)3020(2113)2218(24)169815(2916)12423514(12)23(26)27h210H1H3(H212224)
methyl2(((5(2nitrophenyl)furan2yl)carbonyl)amino)13benzothiazole6carboxylate
methyl2((5(2nitrophenyl)furan2carbonyl)amino)13benzothiazole6carboxylate
methyl2(5(2nitrophenyl)furan2carboxamido)benzo(d)thiazole6carboxylate
MFCD08571803

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Available files

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