Vitas-M small molecule compound

4-nitro-N-[2-(2-oxo-2,6,7,8-tetrahydrocyclopenta[g]chromen-4-yl)-1-benzofuran-3-yl]benzamide

Catalog ID
STK622065
SMILES O=c1oc2cc3CCCc3cc2c(c1)c1oc2c(c1NC(=O)c1ccc(cc1)[N+](=O)[O-])cccc2

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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 C27H18N2O6 MW 466.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N2O6/c30-24-14-21(20-12-16-4-3-5-17(16)13-23(20)34-24)26-25(19-6-1-2-7-22(19)35-26)28-27(31)15-8-10-18(11-9-15)29(32)33/h1-2,6-14H,3-5H2,(H,28,31)
InChIKey
WKBKISLXSSKLSQ-UHFFFAOYSA-N
Synonyms
921160-12-5
(4NITROPHENYL)N(2(2OXO(678TRIHYDROCYCLOPENTA(21G)CHROMEN4YL))BENZO(B)FURAN3YL)CARBOXAMIDE
4nitroN(2(2oxo2678tetrahydrocyclopenta(g)chromen4yl)1benzofuran3yl)benzamide
4nitroN(2(2oxo2678tetrahydrocyclopenta(g)chromen4yl)benzofuran3yl)benzamide
4nitroN(2(2oxo78dihydro6Hcyclopenta(g)chromen4yl)1benzofuran3yl)benzamide
921160125
C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)C4=C(C5=CC=CC=C5O4)NC(=O)C6=CC=C(C=C6)(N+)(=O)(O)
InChI=1SC27H18N2O6c30241421(20121643517(16)1323(20)3424)2625(19612722(19)3526)2827(31)1581018(11915)29(32)33h12614H35H2(H2831)
MFCD08745073
O=c1oc2cc3CCCc3cc2c(c1)c1oc2c(c1NC(=O)c1ccc(cc1)(N+)(=O)(O))cccc2
ZINC000100654770
ZINC100654770

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Available files

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