Vitas-M small molecule compound

4-[(2Z)-2-{1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzenesulfonic acid

Catalog ID
STK391747
SMILES COc1ccc(cc1)c1csc(n1)N1N=C(/C(=N/Nc2ccc(cc2)S(=O)(=O)O)/C1=O)c1ccc(cc1)[N+](=O)[O-]

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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 C25H18N6O7S2 MW 578.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N6O7S2/c1-38-19-10-4-15(5-11-19)21-14-39-25(26-21)30-24(32)23(22(29-30)16-2-8-18(9-3-16)31(33)34)28-27-17-6-12-20(13-7-17)40(35,36)37/h2-14,27H,1H3,(H,35,36,37)/b28-23-
InChIKey
LZSIPSXDRCAQQC-NFFVHWSESA-N
Synonyms

4(((1(4(4METHOXYPHENYL)(13THIAZOL2YL))3(4NITROPHENYL)5OXO12DIAZOLIN4YLIDENE)AZAMETHYL)AMINO)BENZENESULFONICACID
4((2Z)2(1(4(4methoxyphenyl)13thiazol2yl)3(4nitrophenyl)5oxo15dihydro4Hpyrazol4ylidene)hydrazinyl)benzenesulfonicacid
4((2Z)2(1(4(4METHOXYPHENYL)13THIAZOL2YL)3(4NITROPHENYL)5OXOPYRAZOL4YLIDENE)HYDRAZINYL)BENZENESULFONICACID
COC1=CC=C(C=C1)C2=CSC(=N2)N3C(=O)C(=NNC4=CC=C(C=C4)S(=O)(=O)O)C(=N3)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc(cc1)c1csc(n1)N1N=C(C(=NNc2ccc(cc2)S(=O)(=O)O)C1=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC25H18N6O7S2c1381910415(51119)21143925(2621)3024(32)23(22(2930)162818(9316)31(33)34)28271761220(13717)40(3536)37h21427H1H3(H353637)b2823
MFCD01418554
ZINC000101932047
ZINC8424747

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Available files

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