Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-4-methoxy-3-nitrobenzamide
Catalog ID
STK184222
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OC
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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 C25H24N6O4S MW 504.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N6O4S/c1-3-4-5-16-6-10-19(11-7-16)30-28-20-12-9-18(15-21(20)29-30)26-25(36)27-24(32)17-8-13-23(35-2)22(14-17)31(33)34/h6-15H,3-5H2,1-2H3,(H2,26,27,32,36)InChIKey
ZFGLASVTWHDNLU-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)(N+)(=O)(O)
CCCCc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC25H24N6O4Sc13451661019(11716)30282012918(1521(20)2930)2625(36)2724(32)1781323(352)22(1417)31(33)34h615H35H212H3(H226273236)
MFCD02810807
N(((2(4BUTYLPHENYL)(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)(4METHOXY3NITROPHENYL)CARBOXAMIDE
N((2(4BUTYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N((2(4BUTYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
ZINC000008721641
ZINC08721641
ZINC8721641
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