Vitas-M small molecule compound
(2E)-N-(3-chlorophenyl)-2-cyano-3-[1-(2-methoxy-5-nitrophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]prop-2-enamide
Catalog ID
STK179180
SMILES N#C/C(=C\c1cc(n(c1C)c1cc(ccc1OC)[N+](=O)[O-])C)/C(=O)Nc1cccc(c1)Cl
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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 C23H19ClN4O4 MW 450.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN4O4/c1-14-9-16(10-17(13-25)23(29)26-19-6-4-5-18(24)11-19)15(2)27(14)21-12-20(28(30)31)7-8-22(21)32-3/h4-12H,1-3H3,(H,26,29)/b17-10+InChIKey
DBTNKTCYWYGHFF-LICLKQGHSA-NSynonyms
(2E)N(3CHLOROPHENYL)2CYANO3(1(2METHOXY5NITROPHENYL)25DIMETHYL1HPYRROL3YL)PROP2ENAMIDE
(E)N(3chlorophenyl)2cyano3(1(2methoxy5nitrophenyl)25dimethylpyrrol3yl)prop2enamide
CC1=CC(=C(N1C2=C(C=CC(=C2)(N+)(=O)(O))OC)C)C=C(C#N)C(=O)NC3=CC(=CC=C3)Cl
InChI=1SC23H19ClN4O4c114916(1017(1325)23(29)261964518(24)1119)15(2)27(14)211220(28(30)31)7822(21)323h412H13H3(H2629)b1710+
MFCD04364404
N#CC(=Cc1cc(n(c1C)c1cc(ccc1OC)(N+)(=O)(O))C)C(=O)Nc1cccc(c1)Cl
ZINC000009263082
ZINC09263082
ZINC9263082
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