Vitas-M small molecule compound
N,N'-bis(4-phenylbutan-2-yl)bis[1,2,3]triazolo[1,5-a:5',1'-d][3,1,5]benzothiadiazepine-8,10-dicarboxamide
Catalog ID
STL437658
SMILES CC(NC(=O)c1nnn2c1sc1c(nnn1c1c2cccc1)C(=O)NC(CCc1ccccc1)C)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 C32H32N8O2S MW 592.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N8O2S/c1-21(17-19-23-11-5-3-6-12-23)33-29(41)27-31-39(37-35-27)25-15-9-10-16-26(25)40-32(43-31)28(36-38-40)30(42)34-22(2)18-20-24-13-7-4-8-14-24/h3-16,21-22H,17-20H2,1-2H3,(H,33,41)(H,34,42)InChIKey
ZCEPTJLIXJJSPG-UHFFFAOYSA-NSynonyms
CC(CCC1=CC=CC=C1)NC(=O)C2=C3N(C4=CC=CC=C4N5C(=C(N=N5)C(=O)NC(C)CCC6=CC=CC=C6)S3)N=N2
InChI=1SC32H32N8O2Sc121(171923115361223)3329(41)273139(373527)25159101626(25)4032(4331)28(363840)30(42)3422(2)182024137481424h3162122H1720H212H3(H3341)(H3442)
MFCD06244700
NNbis(4phenylbutan2yl)bis(123)triazolo(15a51d)(315)benzothiadiazepine810dicarboxamide
ZINC000001409698
ZINC000001409701
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