Vitas-M small molecule compound

N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-4-methoxy-3-nitrobenzamide

Catalog ID
STK023382
SMILES CCOc1ccc(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 C23H20N6O5S MW 492.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N6O5S/c1-3-34-17-8-6-16(7-9-17)28-26-18-10-5-15(13-19(18)27-28)24-23(35)25-22(30)14-4-11-21(33-2)20(12-14)29(31)32/h4-13H,3H2,1-2H3,(H2,24,25,30,35)
InChIKey
RRPFIPJCGQCRSY-UHFFFAOYSA-N
Synonyms
333739-03-0
333739030
CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)(N+)(=O)(O)
CCOc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))OC
InChI=1SC23H20N6O5Sc1334178616(7917)28261810515(1319(18)2728)2423(35)2522(30)1441121(332)20(1214)29(31)32h413H3H212H3(H224253035)
MFCD02578124
N(((2(4ETHOXYPHENYL)(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)(4METHOXY3NITROPHENYL)CARBOXAMIDE
N((2(4ethoxyphenyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)4methoxy3nitrobenzamide
N((2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N((2(4ETHOXYPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N(2(4ETHOXYPHENYL)2H123BENZOTRIAZOL5YL)N(3NITRO4METHOXYBENZOYL)THIOUREA
STK023382
ZINC000001824016
ZINC01824016
ZINC1824016

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Available files

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