Vitas-M small molecule compound

N-{[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide

Catalog ID
STK248352
SMILES COc1ccc(cc1NC(=S)NC(=O)c1cccc(c1)OC(C)C)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 C25H23N3O3S2 MW 477.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O3S2/c1-15(2)31-18-8-6-7-16(13-18)23(29)28-25(32)27-20-14-17(11-12-21(20)30-3)24-26-19-9-4-5-10-22(19)33-24/h4-15H,1-3H3,(H2,27,28,29,32)
InChIKey
BPWDMBDAMDPTBZ-UHFFFAOYSA-N
Synonyms

CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4S3)OC
InChI=1SC25H23N3O3S2c115(2)311886716(1318)23(29)2825(32)27201417(111221(20)303)2426199451022(19)3324h415H13H3(H227282932)
MFCD03909654
N((5(13benzothiazol2yl)2methoxyphenyl)carbamothioyl)3(propan2yloxy)benzamide
N((5(13BENZOTHIAZOL2YL)2METHOXYPHENYL)CARBAMOTHIOYL)3PROPAN2YLOXYBENZAMIDE
ZINC000005944752
ZINC05944752
ZINC5944752

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.