Vitas-M small molecule compound
7-(3,5-dinitrophenyl)-14H-thiochromeno[2',3':4,5]pyrimido[1,6-a]benzimidazol-14-one
Catalog ID
STK715831
SMILES [O-][N+](=O)c1cc(cc(c1)[N+](=O)[O-])c1nc2sc3ccccc3c(=O)c2c2n1c1ccccc1n2
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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 C23H11N5O5S MW 469.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H11N5O5S/c29-20-15-5-1-4-8-18(15)34-23-19(20)22-24-16-6-2-3-7-17(16)26(22)21(25-23)12-9-13(27(30)31)11-14(10-12)28(32)33/h1-11HInChIKey
CLAHQXZMUQZNQM-UHFFFAOYSA-NSynonyms
879455-40-0(O)(N+)(=O)c1cc(cc(c1)(N+)(=O)(O))c1nc2sc3ccccc3c(=O)c2c2n1c1ccccc1n2
7(35dinitrophenyl)14Hbenzo(45)imidazo(12c)thiochromeno(32e)pyrimidin14one
7(35dinitrophenyl)14Hthiochromeno(2345)pyrimido(16a)benzimidazol14one
879455400
C1=CC=C2C(=C1)C(=O)C3=C(S2)N=C(N4C3=NC5=CC=CC=C54)C6=CC(=CC(=C6)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC23H11N5O5Sc292015514818(15)342319(20)222416623717(16)26(22)21(2523)12913(27(30)31)1114(1012)28(32)33h111H
MFCD06788378
ZINC000009087315
ZINC09087315
ZINC9087315
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