Vitas-M small molecule compound
(2E)-3-(3-nitrophenyl)-N-(phenylcarbamothioyl)prop-2-enamide
Catalog ID
STK148530
SMILES S=C(Nc1ccccc1)NC(=O)/C=C/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 C16H13N3O3S MW 327.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O3S/c20-15(18-16(23)17-13-6-2-1-3-7-13)10-9-12-5-4-8-14(11-12)19(21)22/h1-11H,(H2,17,18,20,23)/b10-9+InChIKey
ATJZUUUQOMMFIO-MDZDMXLPSA-NSynonyms
(2E)3(3NITROPHENYL)N(PHENYLCARBAMOTHIOYL)PROP2ENAMIDE
(E)3(3NITROPHENYL)N(PHENYLCARBAMOTHIOYL)PROP2ENAMIDE
C1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC16H13N3O3Sc2015(1816(23)17136213713)1091254814(1112)19(21)22h111H(H217182023)b109+
MFCD03138209
S=C(Nc1ccccc1)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
ZINC000000456546
ZINC00456546
ZINC456546
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