Vitas-M small molecule compound
diethyl 2,3-dimethylbis[1,2,3]triazolo[1,5-a:5',1'-d][3,1,5]benzothiadiazepine-8,10-dicarboxylate
Catalog ID
STL438666
SMILES CCOC(=O)c1nnn2c1sc1c(nnn1c1c2cc(C)c(c1)C)C(=O)OCC
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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 C18H18N6O4S MW 414.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O4S/c1-5-27-17(25)13-15-23(21-19-13)11-7-9(3)10(4)8-12(11)24-16(29-15)14(20-22-24)18(26)28-6-2/h7-8H,5-6H2,1-4H3InChIKey
VWRUUNQNQLXYDD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C2N(C3=C(C=C(C(=C3)C)C)N4C(=C(N=N4)C(=O)OCC)S2)N=N1
diethyl23dimethylbis(123)triazolo(15a51d)(315)benzothiadiazepine810dicarboxylate
InChI=1SC18H18N6O4Sc152717(25)131523(211913)1179(3)10(4)812(11)2416(2915)14(202224)18(26)2862h78H56H214H3
MFCD06244669
ZINC000001409630
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