Vitas-M small molecule compound
N-[(3-chloro-4-methylphenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Catalog ID
STK059342
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(c(c1)Cl)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 C17H16ClN3O4S MW 393.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O4S/c1-3-25-15-7-5-11(8-14(15)21(23)24)16(22)20-17(26)19-12-6-4-10(2)13(18)9-12/h4-9H,3H2,1-2H3,(H2,19,20,22,26)InChIKey
MPVKZMVSLFJNKC-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)C)Cl)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc(c(c1)Cl)C
InChI=1SC17H16ClN3O4Sc1325157511(814(15)21(23)24)16(22)2017(26)19126410(2)13(18)912h49H3H212H3(H219202226)
MFCD02626953
N((3CHLORO4METHYLPHENYL)CARBAMOTHIOYL)4ETHOXY3NITROBENZAMIDE
STK059342
ZINC000001174091
ZINC01174091
ZINC1174091
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