Vitas-M small molecule compound
N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-4-nitrobenzamide
Catalog ID
STK079257
SMILES S=C(NC(=O)c1ccc(cc1)[N+](=O)[O-])Nc1ccc(c(c1)c1oc2c(n1)cc(c(c2)C)C)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 C23H17ClN4O4S MW 480.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O4S/c1-12-9-19-20(10-13(12)2)32-22(26-19)17-11-15(5-8-18(17)24)25-23(33)27-21(29)14-3-6-16(7-4-14)28(30)31/h3-11H,1-2H3,(H2,25,27,29,33)InChIKey
SYWSBNXMYHNVIL-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1C)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O))Cl
InChI=1SC23H17ClN4O4Sc11291920(1013(12)2)3222(2619)171115(5818(17)24)2523(33)2721(29)143616(7414)28(30)31h311H12H3(H225272933)
MFCD02221864
N((4CHLORO3(56DIMETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)4NITROBENZAMIDE
S=C(NC(=O)c1ccc(cc1)(N+)(=O)(O))Nc1ccc(c(c1)c1oc2c(n1)cc(c(c2)C)C)Cl
STK079257
ZINC000009660126
ZINC09660126
ZINC9660126
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