Vitas-M small molecule compound
methyl 4-(3-{(1E)-2-cyano-3-[(furan-2-ylmethyl)amino]-3-oxoprop-1-en-1-yl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK183203
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)C(=O)OC)C)/C(=O)NCc1ccco1
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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 C23H21N3O4 MW 403.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4/c1-15-11-18(12-19(13-24)22(27)25-14-21-5-4-10-30-21)16(2)26(15)20-8-6-17(7-9-20)23(28)29-3/h4-12H,14H2,1-3H3,(H,25,27)/b19-12+InChIKey
KKICEALXYPWPNY-XDHOZWIPSA-NSynonyms
340272-35-7(E)methyl4(3(2cyano3((furan2ylmethyl)amino)3oxoprop1en1yl)25dimethyl1Hpyrrol1yl)benzoate
340272357
CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)OC)C)C=C(C#N)C(=O)NCC3=CC=CO3
InChI=1SC23H21N3O4c1151118(1219(1324)22(27)25142154103021)16(2)26(15)208617(7920)23(28)293h412H14H213H3(H2527)b1912+
METHYL4(3((1E)2CYANO2(N(2FURYLMETHYL)CARBAMOYL)VINYL)25DIMETHYLPYRROLYL)BENZOATE
METHYL4(3((1E)2CYANO3((FURAN2YLMETHYL)AMINO)3OXOPROP1EN1YL)25DIMETHYL1HPYRROL1YL)BENZOATE
METHYL4(3((E)2CYANO3(FURAN2YLMETHYLAMINO)3OXOPROP1ENYL)25DIMETHYLPYRROL1YL)BENZOATE
MFCD02195340
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)C(=O)OC)C)C(=O)NCc1ccco1
ZINC000000781389
ZINC00781389
ZINC781389
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.