Vitas-M small molecule compound
(2E)-3-{5-[(4-chlorophenyl)sulfanyl]thiophen-2-yl}-2-(4-nitrophenyl)prop-2-enenitrile
Catalog ID
STK195701
SMILES N#C/C(=C/c1ccc(s1)Sc1ccc(cc1)Cl)/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 C19H11ClN2O2S2 MW 398.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H11ClN2O2S2/c20-15-3-7-17(8-4-15)25-19-10-9-18(26-19)11-14(12-21)13-1-5-16(6-2-13)22(23)24/h1-11H/b14-11-InChIKey
BXADWASHGXBABM-KAMYIIQDSA-NSynonyms
(2E)3(5((4CHLOROPHENYL)SULFANYL)THIOPHEN2YL)2(4NITROPHENYL)PROP2ENENITRILE
(E)3(5(4CHLOROPHENYL)SULFANYLTHIOPHEN2YL)2(4NITROPHENYL)PROP2ENENITRILE
C1=CC(=CC=C1C(=CC2=CC=C(S2)SC3=CC=C(C=C3)Cl)C#N)(N+)(=O)(O)
InChI=1SC19H11ClN2O2S2c20153717(8415)251910918(2619)1114(1221)131516(6213)22(23)24h111Hb1411
MFCD04347315
N#CC(=Cc1ccc(s1)Sc1ccc(cc1)Cl)c1ccc(cc1)(N+)(=O)(O)
ZINC000012363415
ZINC12363415
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