Vitas-M small molecule compound
(2E)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]-3-{[4-(propan-2-yl)phenyl]amino}prop-2-enenitrile
Catalog ID
STK804017
SMILES N#C/C(=C\Nc1ccc(cc1)C(C)C)/c1scc(n1)c1ccc(cc1)[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 C21H18N4O2S MW 390.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O2S/c1-14(2)15-3-7-18(8-4-15)23-12-17(11-22)21-24-20(13-28-21)16-5-9-19(10-6-16)25(26)27/h3-10,12-14,23H,1-2H3/b17-12+InChIKey
WIGVYEZOWANAEI-SFQUDFHCSA-NSynonyms
(2E)2(4(4nitrophenyl)13thiazol2yl)3((4(propan2yl)phenyl)amino)prop2enenitrile
(E)2(4(4NITROPHENYL)13THIAZOL2YL)3(4PROPAN2YLANILINO)PROP2ENENITRILE
CC(C)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC21H18N4O2Sc114(2)153718(8415)231217(1122)212420(132821)165919(10616)25(26)27h310121423H12H3b1712+
MFCD01958793
N#CC(=CNc1ccc(cc1)C(C)C)c1scc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000007348025
ZINC7348025
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