Vitas-M small molecule compound
dimethyl 2-[(1H-benzotriazol-1-ylmethyl)amino]-1,3-benzothiazole-5,6-dicarboxylate
Catalog ID
STK366408
SMILES COC(=O)c1cc2sc(nc2cc1C(=O)OC)NCn1nnc2c1cccc2
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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 C18H15N5O4S MW 397.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O4S/c1-26-16(24)10-7-13-15(8-11(10)17(25)27-2)28-18(20-13)19-9-23-14-6-4-3-5-12(14)21-22-23/h3-8H,9H2,1-2H3,(H,19,20)InChIKey
AVYTUYXLXXVGCQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC2=C(C=C1C(=O)OC)SC(=N2)NCN3C4=CC=CC=C4N=N3
dimethyl2((1Hbenzotriazol1ylmethyl)amino)13benzothiazole56dicarboxylate
DIMETHYL2(BENZOTRIAZOL1YLMETHYLAMINO)13BENZOTHIAZOLE56DICARBOXYLATE
InChI=1SC18H15N5O4Sc12616(24)1071315(811(10)17(25)272)2818(2013)1992314643512(14)212223h38H9H212H3(H1920)
METHYL2((BENZOTRIAZOLYLMETHYL)AMINO)6(METHOXYCARBONYL)BENZOTHIAZOLE5CARBOXYLATE
MFCD00356259
ZINC000003018493
ZINC03018493
ZINC3018493
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