Vitas-M small molecule compound

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

Catalog ID
STK573135
SMILES CC(Cc1nnc(s1)N1C(=O)c2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)c1c(o2)ccc(c1)Cl)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 C23H17ClN4O5S MW 496.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O5S/c1-11(2)9-17-25-26-23(34-17)27-19(12-3-6-14(7-4-12)28(31)32)18-20(29)15-10-13(24)5-8-16(15)33-21(18)22(27)30/h3-8,10-11,19H,9H2,1-2H3
InChIKey
BRZCPSWHHBBJMM-UHFFFAOYSA-N
Synonyms
847338-07-2
7chloro2(5(2methylpropyl)134thiadiazol2yl)1(4nitrophenyl)12dihydrochromeno(23c)pyrrole39dione
7CHLORO2(5(2METHYLPROPYL)134THIADIAZOL2YL)1(4NITROPHENYL)1HCHROMENO(23C)PYRROLE39DIONE
7chloro2(5isobutyl134thiadiazol2yl)1(4nitrophenyl)12dihydrochromeno(23c)pyrrole39dione
847338072
CC(C)CC1=NN=C(S1)N2C(C3=C(C2=O)OC4=C(C3=O)C=C(C=C4)Cl)C5=CC=C(C=C5)(N+)(=O)(O)
CC(Cc1nnc(s1)N1C(=O)c2c(C1c1ccc(cc1)(N+)(=O)(O))c(=O)c1c(o2)ccc(c1)Cl)C
InChI=1SC23H17ClN4O5Sc111(2)917252623(3417)2719(123614(7412)28(31)32)1820(29)151013(24)5816(15)3321(18)22(27)30h38101119H9H212H3
MFCD04179940
ZINC000002211216
ZINC000002211217

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Available files

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