Vitas-M small molecule compound

N-{[2-(naphthalen-2-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide

Catalog ID
STK100189
SMILES S=C(NC(=O)c1ccccc1)Nc1ccc2c(c1)nc(o2)c1ccc2c(c1)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 C25H17N3O2S MW 423.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O2S/c29-23(17-7-2-1-3-8-17)28-25(31)26-20-12-13-22-21(15-20)27-24(30-22)19-11-10-16-6-4-5-9-18(16)14-19/h1-15H,(H2,26,28,29,31)
InChIKey
HJRRLBDPOKYUOD-UHFFFAOYSA-N
Synonyms

C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC5=CC=CC=C5C=C4
InChI=1SC25H17N3O2Sc2923(177213817)2825(31)262012132221(1520)2724(3022)19111016645918(16)1419h115H(H226282931)
MFCD02630039
N((2(NAPHTHALEN2YL)13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
N((2NAPHTHALEN2YL13BENZOXAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
ZINC000002978526
ZINC02978526
ZINC2978526

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Available files

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