Vitas-M small molecule compound
2-methyl-N-[3-({[(4-nitrophenyl)carbonyl]carbamothioyl}amino)phenyl]benzamide
Catalog ID
STK010518
SMILES S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1cccc(c1)NC(=O)c1ccccc1C
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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 C22H18N4O4S MW 434.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O4S/c1-14-5-2-3-8-19(14)21(28)23-16-6-4-7-17(13-16)24-22(31)25-20(27)15-9-11-18(12-10-15)26(29)30/h2-13H,1H3,(H,23,28)(H2,24,25,27,31)InChIKey
SQNPSVBDAWWSCP-UHFFFAOYSA-NSynonyms
(2METHYLPHENYL)N(3((((4NITROPHENYL)CARBONYLAMINO)THIOXOMETHYL)AMINO)PHENYL)CARBOXAMIDE
2METHYLN(3((((4NITROPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)PHENYL)BENZAMIDE
2METHYLN(3((4NITROBENZOYL)CARBAMOTHIOYLAMINO)PHENYL)BENZAMIDE
CC1=CC=CC=C1C(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC22H18N4O4Sc114523819(14)21(28)231664717(1316)2422(31)2520(27)1591118(121015)26(29)30h213H1H3(H2328)(H224252731)
MFCD02802754
S=C(NC(=O)c1ccc(cc1)(N+)(=O)(O))Nc1cccc(c1)NC(=O)c1ccccc1C
STK010518
ZINC000001185883
ZINC01185883
ZINC1185883
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