Vitas-M small molecule compound
N-{[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl}-4-methoxy-3-nitrobenzamide
Catalog ID
STK390670
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)C(=O)C
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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 C21H23N5O5S MW 457.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O5S/c1-14(27)24-9-11-25(12-10-24)17-6-4-16(5-7-17)22-21(32)23-20(28)15-3-8-19(31-2)18(13-15)26(29)30/h3-8,13H,9-12H2,1-2H3,(H2,22,23,28,32)InChIKey
IAZMWVRKKXITLM-UHFFFAOYSA-NSynonyms
688012-45-51(4(4ACETYLPIPERAZIN1YL)PHENYL)3(4METHOXY3NITROBENZOYL)THIOUREA
688012455
CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc(cc1)N1CCN(CC1)C(=O)C
InChI=1SC21H23N5O5Sc114(27)2491125(121024)176416(5717)2221(32)2320(28)153819(312)18(1315)26(29)30h3813H912H212H3(H222232832)
MFCD02810935
N(((4(4ACETYLPIPERAZINYL)PHENYL)AMINO)THIOXOMETHYL)(4METHOXY3NITROPHENYL)CARBOXAMIDE
N((4(4acetylpiperazin1yl)phenyl)carbamothioyl)4methoxy3nitrobenzamide
ZINC000004089152
ZINC04089152
ZINC4089152
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