Vitas-M small molecule compound
1,3-dimethyl-5-(4-nitrophenyl)-6-nitroso-5,6-dihydropyrimido[4,5-b][1,5]benzoxazepine-2,4(1H,3H)-dione
Catalog ID
STL321735
SMILES O=NN1c2ccccc2Oc2c(C1c1ccc(cc1)[N+](=O)[O-])c(=O)n(C)c(=O)n2C
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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 C19H15N5O6 MW 409.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O6/c1-21-17(25)15-16(11-7-9-12(10-8-11)24(28)29)23(20-27)13-5-3-4-6-14(13)30-18(15)22(2)19(21)26/h3-10,16H,1-2H3InChIKey
CCRGPJWWRZTQET-UHFFFAOYSA-NSynonyms
371228-00-113dimethyl5(4nitrophenyl)6nitroso56dihydrobenzo(b)pyrimido(54f)(14)oxazepine24(1H3H)dione
13dimethyl5(4nitrophenyl)6nitroso56dihydropyrimido(45b)(15)benzoxazepine24(1H3H)dione
13DIMETHYL5(4NITROPHENYL)6NITROSO5HPYRIMIDO(45B)(15)BENZOXAZEPINE24DIONE
371228001
CN1C2=C(C(N(C3=CC=CC=C3O2)N=O)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)N(C1=O)C
InChI=1SC19H15N5O6c12117(25)1516(117912(10811)24(28)29)23(2027)13534614(13)3018(15)22(2)19(21)26h31016H12H3
MFCD01090397
O=NN1c2ccccc2Oc2c(C1c1ccc(cc1)(N+)(=O)(O))c(=O)n(C)c(=O)n2C
ZINC000013511103
ZINC000013511107
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