Vitas-M small molecule compound
4-butoxy-N-[(4-chloro-3-nitrophenyl)carbamothioyl]benzamide
Catalog ID
STK000227
SMILES CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1ccc(c(c1)[N+](=O)[O-])Cl
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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 C18H18ClN3O4S MW 407.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3O4S/c1-2-3-10-26-14-7-4-12(5-8-14)17(23)21-18(27)20-13-6-9-15(19)16(11-13)22(24)25/h4-9,11H,2-3,10H2,1H3,(H2,20,21,23,27)InChIKey
AQKAFVFPJQZNMK-UHFFFAOYSA-NSynonyms
6454-18-84BUTOXYN((4CHLORO3NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
6454188
CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)Cl)(N+)(=O)(O)
CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC18H18ClN3O4Sc1231026147412(5814)17(23)2118(27)20136915(19)16(1113)22(24)25h4911H2310H21H3(H220212327)
MFCD02626847
STK000227
ZINC000002985134
ZINC02985134
ZINC2985134
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