Vitas-M small molecule compound
2-chloro-N-{[2-(naphthalen-1-yl)-2H-benzotriazol-5-yl]carbamothioyl}-5-nitrobenzamide
Catalog ID
STK380960
SMILES S=C(NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])Nc1ccc2c(c1)nn(n2)c1cccc2c1cccc2
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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 C24H15ClN6O3S MW 502.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15ClN6O3S/c25-19-10-9-16(31(33)34)13-18(19)23(32)27-24(35)26-15-8-11-20-21(12-15)29-30(28-20)22-7-3-5-14-4-1-2-6-17(14)22/h1-13H,(H2,26,27,32,35)InChIKey
BTWGWSLAVAMYDS-UHFFFAOYSA-NSynonyms
(2CHLORO5NITROPHENYL)N(((2NAPHTHYL(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)CARBOXAMIDE
2chloroN((2(naphthalen1yl)2Hbenzotriazol5yl)carbamothioyl)5nitrobenzamide
2CHLORON((2NAPHTHALEN1YLBENZOTRIAZOL5YL)CARBAMOTHIOYL)5NITROBENZAMIDE
C1=CC=C2C(=C1)C=CC=C2N3N=C4C=CC(=CC4=N3)NC(=S)NC(=O)C5=C(C=CC(=C5)(N+)(=O)(O))Cl
InChI=1SC24H15ClN6O3Sc251910916(31(33)34)1318(19)23(32)2724(35)26158112021(1215)2930(2820)2273514412617(14)22h113H(H226273235)
MFCD03648636
S=C(NC(=O)c1cc(ccc1Cl)(N+)(=O)(O))Nc1ccc2c(c1)nn(n2)c1cccc2c1cccc2
ZINC000008721690
ZINC08721690
ZINC8721690
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