Vitas-M small molecule compound

7-chloro-2-(5-ethyl-1,3,4-thiadiazol-2-yl)-1-(3-nitrophenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione

Catalog ID
STL053193
SMILES CCc1nnc(s1)N1C(=O)c2c(C1c1cccc(c1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)Cl

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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 C21H13ClN4O5S MW 468.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN4O5S/c1-2-15-23-24-21(32-15)25-17(10-4-3-5-12(8-10)26(29)30)16-18(27)13-9-11(22)6-7-14(13)31-19(16)20(25)28/h3-9,17H,2H2,1H3
InChIKey
XTFAWEHQVBNDKT-UHFFFAOYSA-N
Synonyms
632309-62-7
632309627
7CHLORO2(5ETHYL(134THIADIAZOL2YL))1(3NITROPHENYL)CHROMENO(23C)3PYRROLINE39DIONE
7chloro2(5ethyl134thiadiazol2yl)1(3nitrophenyl)12dihydrochromeno(23c)pyrrole39dione
7CHLORO2(5ETHYL134THIADIAZOL2YL)1(3NITROPHENYL)1HCHROMENO(23C)PYRROLE39DIONE
CCC1=NN=C(S1)N2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)Cl)C5=CC(=CC=C5)(N+)(=O)(O)
CCc1nnc(s1)N1C(=O)c2c(C1c1cccc(c1)(N+)(=O)(O))c(=O)c1c(o2)ccc(c1)Cl
InChI=1SC21H13ClN4O5Sc1215232421(3215)2517(1043512(810)26(29)30)1618(27)13911(22)6714(13)3119(16)20(25)28h3917H2H21H3
MFCD04184586
ZINC000002403695
ZINC000002403696

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Available files

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