Vitas-M small molecule compound
N-{[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamothioyl}-2-nitrobenzamide
Catalog ID
STK163550
SMILES S=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1cc(ccc1Cl)c1nc2c(o1)cccc2
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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 C21H13ClN4O4S MW 452.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13ClN4O4S/c22-14-10-9-12(20-23-15-6-2-4-8-18(15)30-20)11-16(14)24-21(31)25-19(27)13-5-1-3-7-17(13)26(28)29/h1-11H,(H2,24,25,27,31)InChIKey
YXEOVFWSSULLMN-UHFFFAOYSA-NSynonyms
C1=CC=C(C(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)Cl)(N+)(=O)(O)
InChI=1SC21H13ClN4O4Sc221410912(202315624818(15)3020)1116(14)2421(31)2519(27)13513717(13)26(28)29h111H(H224252731)
MFCD02821767
N((5(13BENZOXAZOL2YL)2CHLOROPHENYL)CARBAMOTHIOYL)2NITROBENZAMIDE
S=C(NC(=O)c1ccccc1(N+)(=O)(O))Nc1cc(ccc1Cl)c1nc2c(o1)cccc2
ZINC000009846213
ZINC09846213
ZINC9846213
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