Vitas-M small molecule compound

(2E)-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide

Catalog ID
STK328897
SMILES CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)NC(=O)/C=C/c1ccc(cc1)C

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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 C19H19N3O4S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S/c1-3-26-15-9-10-16(17(12-15)22(24)25)20-19(27)21-18(23)11-8-14-6-4-13(2)5-7-14/h4-12H,3H2,1-2H3,(H2,20,21,23,27)/b11-8+
InChIKey
IHOWGNSDOKKWMZ-DHZHZOJOSA-N
Synonyms
1164549-96-5
(2E)N((4ethoxy2nitrophenyl)carbamothioyl)3(4methylphenyl)prop2enamide
(E)N((4ETHOXY2NITROANILINO)SULFANYLIDENEMETHYL)3(4METHYLPHENYL)2PROPENAMIDE
(E)N((4ETHOXY2NITROPHENYL)CARBAMOTHIOYL)3(4METHYLPHENYL)PROP2ENAMIDE
(E)N((4ethoxy2nitrophenyl)carbamothioyl)3(ptolyl)acrylamide
(E)N((4ETHOXY2NITROPHENYL)THIOCARBAMOYL)3(PTOLYL)ACRYLAMIDE
1164549965
CCOC1=CC(=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)C)(N+)(=O)(O)
CCOc1ccc(c(c1)(N+)(=O)(O))NC(=S)NC(=O)C=Cc1ccc(cc1)C
InChI=1SC19H19N3O4Sc13261591016(17(1215)22(24)25)2019(27)2118(23)118146413(2)5714h412H3H212H3(H220212327)b118+
MFCD00498931
N(((4ETHOXY2NITROPHENYL)AMINO)CARBONOTHIOYL)3(4METHYLPHENYL)ACRYLAMIDE
ZINC000004889354
ZINC04889354
ZINC4889354

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.