Vitas-M small molecule compound
(2Z)-3-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK529971
SMILES N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]
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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 C20H15ClN4O4S MW 442.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN4O4S/c1-28-18-8-16(19(29-2)7-15(18)21)23-10-13(9-22)20-24-17(11-30-20)12-4-3-5-14(6-12)25(26)27/h3-8,10-11,23H,1-2H3/b13-10-InChIKey
SRDJVVDEZFQOIC-RAXLEYEMSA-NSynonyms
(2Z)3((4chloro25dimethoxyphenyl)amino)2(4(3nitrophenyl)13thiazol2yl)prop2enenitrile
(Z)3((4chloro25dimethoxyphenyl)amino)2(4(3nitrophenyl)thiazol2yl)acrylonitrile
(Z)3(4CHLORO25DIMETHOXYANILINO)2(4(3NITROPHENYL)13THIAZOL2YL)PROP2ENENITRILE
COC1=CC(=C(C=C1NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)(N+)(=O)(O))OC)Cl
InChI=1SC20H15ClN4O4Sc12818816(19(292)715(18)21)231013(922)202417(113020)1243514(612)25(26)27h38101123H12H3b1310
MFCD01958349
N#CC(=CNc1cc(OC)c(cc1OC)Cl)c1scc(n1)c1cccc(c1)(N+)(=O)(O)
ZINC000001836941
ZINC01836941
ZINC1836941
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