Vitas-M small molecule compound
N-{[5-(butan-2-yl)-2-hydroxyphenyl]carbamothioyl}-4-nitrobenzamide
Catalog ID
STK040477
SMILES CCC(c1ccc(c(c1)NC(=S)NC(=O)c1ccc(cc1)[N+](=O)[O-])O)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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c1-3-11(2)13-6-9-16(22)15(10-13)19-18(26)20-17(23)12-4-7-14(8-5-12)21(24)25/h4-11,22H,3H2,1-2H3,(H2,19,20,23,26)InChIKey
RGUPKGLMCHIULH-UHFFFAOYSA-NSynonyms
1(5SECBUTYL2HYDROXYPHENYL)3(4NITROBENZOYL)THIOUREA
CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
CCC(c1ccc(c(c1)NC(=S)NC(=O)c1ccc(cc1)(N+)(=O)(O))O)C
InChI=1SC18H19N3O4Sc1311(2)136916(22)15(1013)1918(26)2017(23)124714(8512)21(24)25h41122H3H212H3(H219202326)
MFCD02577599
N(((2HYDROXY5(METHYLPROPYL)PHENYL)AMINO)THIOXOMETHYL)(4NITROPHENYL)CARBOXAMIDE
N((5(BUTAN2YL)2HYDROXYPHENYL)CARBAMOTHIOYL)4NITROBENZAMIDE
N((5BUTAN2YL2HYDROXYPHENYL)CARBAMOTHIOYL)4NITROBENZAMIDE
N(5SECBUTYL2HYDROXYPHENYL)N(4NITROBENZOYL)THIOUREA
STK040477
ZINC000000878039
ZINC000000878040
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