Vitas-M small molecule compound

3-methoxy-N-{[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}naphthalene-2-carboxamide

Catalog ID
STK180604
SMILES COc1cc2ccccc2cc1C(=O)NC(=S)Nc1ccc2c(c1)nc(o2)c1ccccc1C

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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 C27H21N3O3S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O3S/c1-16-7-3-6-10-20(16)26-29-22-15-19(11-12-23(22)33-26)28-27(34)30-25(31)21-13-17-8-4-5-9-18(17)14-24(21)32-2/h3-15H,1-2H3,(H2,28,30,31,34)
InChIKey
ICJNNLQPVUAZSI-UHFFFAOYSA-N
Synonyms

3METHOXYN((2(2METHYLPHENYL)13BENZOXAZOL5YL)CARBAMOTHIOYL)NAPHTHALENE2CARBOXAMIDE
CC1=CC=CC=C1C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5C=C4OC
InChI=1SC27H21N3O3Sc1167361020(16)2629221519(111223(22)3326)2827(34)3025(31)211317845918(17)1424(21)322h315H12H3(H228303134)
MFCD03137990
ZINC000002844166
ZINC02844166
ZINC2844166

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Available files

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