Vitas-M small molecule compound
3-[(4-methoxy-3-nitrobenzyl)sulfanyl]-4-phenyl-5-(2-phenylethyl)-4H-1,2,4-triazole
Catalog ID
STK272350
SMILES COc1ccc(cc1[N+](=O)[O-])CSc1nnc(n1c1ccccc1)CCc1ccccc1
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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 C24H22N4O3S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3S/c1-31-22-14-12-19(16-21(22)28(29)30)17-32-24-26-25-23(15-13-18-8-4-2-5-9-18)27(24)20-10-6-3-7-11-20/h2-12,14,16H,13,15,17H2,1H3InChIKey
KHOYRRKKQXITSG-UHFFFAOYSA-NSynonyms
3((4methoxy3nitrobenzyl)sulfanyl)4phenyl5(2phenylethyl)4H124triazole
3((4methoxy3nitrophenyl)methylsulfanyl)4phenyl5(2phenylethyl)124triazole
3((4METHOXY3NITROPHENYL)METHYLSULFANYL)5PHENETHYL4PHENYL124TRIAZOLE
COC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CCC4=CC=CC=C4)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))CSc1nnc(n1c1ccccc1)CCc1ccccc1
InChI=1SC24H22N4O3Sc13122141219(1621(22)28(29)30)173224262523(1513188425918)27(24)20106371120h2121416H131517H21H3
MFCD06621059
ZINC000002839350
ZINC02839350
ZINC2839350
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