Vitas-M small molecule compound
methyl 4-{5-[(4-methoxy-3-nitrobenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoate
Catalog ID
STK999235
SMILES COC(=O)c1ccc(cc1)n1nnnc1SCc1ccc(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 C17H15N5O5S MW 401.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5O5S/c1-26-15-8-3-11(9-14(15)22(24)25)10-28-17-18-19-20-21(17)13-6-4-12(5-7-13)16(23)27-2/h3-9H,10H2,1-2H3InChIKey
PDXBPDHDHLTWDV-UHFFFAOYSA-NSynonyms
346464-92-4346464924
COC(=O)c1ccc(cc1)n1nnnc1SCc1ccc(c(c1)(N+)(=O)(O))OC
COC1=C(C=C(C=C1)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)OC)(N+)(=O)(O)
InChI=1SC17H15N5O5Sc126158311(914(15)22(24)25)10281718192021(17)136412(5713)16(23)272h39H10H212H3
methyl4(5((4methoxy3nitrobenzyl)sulfanyl)1Htetrazol1yl)benzoate
methyl4(5((4methoxy3nitrobenzyl)thio)1Htetrazol1yl)benzoate
METHYL4(5((4METHOXY3NITROPHENYL)METHYLSULFANYL)TETRAZOL1YL)BENZOATE
MFCD01580929
ZINC000001084490
ZINC01084490
ZINC1084490
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