Vitas-M small molecule compound
N-{[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl}-4-butoxybenzamide
Catalog ID
STK035196
SMILES CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(s1)cccc2
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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 C26H25N3O2S2 MW 475.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O2S2/c1-3-4-16-31-19-14-12-18(13-15-19)24(30)29-26(32)28-21-10-7-8-20(17(21)2)25-27-22-9-5-6-11-23(22)33-25/h5-15H,3-4,16H2,1-2H3,(H2,28,29,30,32)InChIKey
WDKFYWNHHTVUMJ-UHFFFAOYSA-NSynonyms
CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2C)C3=NC4=CC=CC=C4S3
CCCCOc1ccc(cc1)C(=O)NC(=S)Nc1cccc(c1C)c1nc2c(s1)cccc2
InChI=1SC26H25N3O2S2c134163119141218(131519)24(30)2926(32)2821107820(17(21)2)2527229561123(22)3325h515H3416H212H3(H228293032)
MFCD02626868
N((3(13BENZOTHIAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)4BUTOXYBENZAMIDE
STK035196
ZINC000002994763
ZINC02994763
ZINC2994763
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