Vitas-M small molecule compound
methyl 4-{[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]methyl}benzoate
Catalog ID
STK409529
SMILES COC(=O)c1ccc(cc1)CSc1nc2c(s1)cc(cc2)[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 C16H12N2O4S2 MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O4S2/c1-22-15(19)11-4-2-10(3-5-11)9-23-16-17-13-7-6-12(18(20)21)8-14(13)24-16/h2-8H,9H2,1H3InChIKey
JETKLZCPXVCOGI-UHFFFAOYSA-NSynonyms
522626-25-1522626251
COC(=O)C1=CC=C(C=C1)CSC2=NC3=C(S2)C=C(C=C3)(N+)(=O)(O)
COC(=O)c1ccc(cc1)CSc1nc2c(s1)cc(cc2)(N+)(=O)(O)
InChI=1SC16H12N2O4S2c12215(19)114210(3511)9231617137612(18(20)21)814(13)2416h28H9H21H3
methyl4(((6nitro13benzothiazol2yl)sulfanyl)methyl)benzoate
METHYL4((6NITRO13BENZOTHIAZOL2YL)SULFANYLMETHYL)BENZOATE
METHYL4((6NITROBENZOTHIAZOL2YLTHIO)METHYL)BENZOATE
MFCD03484482
ZINC000003247670
ZINC03247670
ZINC3247670
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