Vitas-M small molecule compound
N-{[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}-4-methoxy-3-nitrobenzamide
Catalog ID
STK096507
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(o1)c(C)cc(c2)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 C25H22N4O5S MW 490.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O5S/c1-13-10-14(2)22-19(11-13)26-24(34-22)17-6-5-7-18(15(17)3)27-25(35)28-23(30)16-8-9-21(33-4)20(12-16)29(31)32/h5-12H,1-4H3,(H2,27,28,30,35)InChIKey
KLAGYCKXIMYYGI-UHFFFAOYSA-NSynonyms
333739-18-7333739187
CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=S)NC(=O)C4=CC(=C(C=C4)OC)(N+)(=O)(O))C)C
COc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(o1)c(C)cc(c2)C
InChI=1SC25H22N4O5Sc1131014(2)2219(1113)2624(3422)1765718(15(17)3)2725(35)2823(30)168921(334)20(1216)29(31)32h512H14H3(H227283035)
MFCD02578139
N(((3(57DIMETHYLBENZOXAZOL2YL)2METHYLPHENYL)AMINO)THIOXOMETHYL)(4METHOXY3NITROPHENYL)CARBOXAMIDE
N((3(57DIMETHYL13BENZOXAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)4METHOXY3NITROBENZAMIDE
N((3(57dimethylbenzo(d)oxazol2yl)2methylphenyl)carbamothioyl)4methoxy3nitrobenzamide
N(3(57DIMETHYL13BENZOXAZOL2YL)2METHYLPHENYL)N(3NITRO4METHOXYBENZOYL)THIOUREA
STK096507
ZINC000001849163
ZINC01849163
ZINC1849163
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