Vitas-M small molecule compound
2-chloro-N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-5-nitrobenzamide
Catalog ID
STK209617
SMILES S=C(NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])Nc1nc2c(s1)cc(cc2)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 C15H8Cl2N4O3S2 MW 427.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8Cl2N4O3S2/c16-7-1-4-11-12(5-7)26-15(18-11)20-14(25)19-13(22)9-6-8(21(23)24)2-3-10(9)17/h1-6H,(H2,18,19,20,22,25)InChIKey
WYKCNFXOKCPHCZ-UHFFFAOYSA-NSynonyms
637316-59-72CHLORON((6CHLORO13BENZOTHIAZOL2YL)CARBAMOTHIOYL)5NITROBENZAMIDE
637316597
C1=CC(=C(C=C1(N+)(=O)(O))C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)Cl)Cl
InChI=1SC15H8Cl2N4O3S2c167141112(57)2615(1811)2014(25)1913(22)968(21(23)24)2310(9)17h16H(H21819202225)
MFCD03977886
S=C(NC(=O)c1cc(ccc1Cl)(N+)(=O)(O))Nc1nc2c(s1)cc(cc2)Cl
ZINC000003314864
ZINC03314864
ZINC3314864
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