Vitas-M small molecule compound
6-iodo-3-(2-methylphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
Catalog ID
STK769764
SMILES Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/c1ccc(o1)[N+](=O)[O-])c1ccccc1C
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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 C21H14IN3O4 MW 499.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14IN3O4/c1-13-4-2-3-5-18(13)24-19(10-7-15-8-11-20(29-15)25(27)28)23-17-9-6-14(22)12-16(17)21(24)26/h2-12H,1H3/b10-7+InChIKey
AKEBAIHBHUXGLU-JXMROGBWSA-NSynonyms
429654-01-3(E)6iodo2(2(5nitrofuran2yl)vinyl)3(otolyl)quinazolin4(3H)one
429654013
6IODO3(2METHYLPHENYL)2((E)2(5NITROFURAN2YL)ETHENYL)QUINAZOLIN4(3H)ONE
6IODO3(2METHYLPHENYL)2((E)2(5NITROFURAN2YL)ETHENYL)QUINAZOLIN4ONE
CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=C(O4)(N+)(=O)(O)
Ic1ccc2c(c1)c(=O)n(c(n2)C=Cc1ccc(o1)(N+)(=O)(O))c1ccccc1C
InChI=1SC21H14IN3O4c113423518(13)2419(1071581120(2915)25(27)28)23179614(22)1216(17)21(24)26h212H1H3b107+
MFCD03138196
ZINC000008737846
ZINC08737846
ZINC8737846
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