Vitas-M small molecule compound

N-({2-[(5-chloro-2-methoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)-3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

Catalog ID
STK548406
SMILES COc1ccc(cc1C(=O)NNC(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl)Cl

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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 C20H15Cl3N4O4S MW 513.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15Cl3N4O4S/c1-9-15(17(27-31-9)16-12(22)4-3-5-13(16)23)19(29)24-20(32)26-25-18(28)11-8-10(21)6-7-14(11)30-2/h3-8H,1-2H3,(H,25,28)(H2,24,26,29,32)
InChIKey
FPNFYEFTGBSACR-UHFFFAOYSA-N
Synonyms
400872-26-6
400872266
CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC(=S)NNC(=O)C3=C(C=CC(=C3)Cl)OC
InChI=1SC20H15Cl3N4O4Sc1915(17(27319)1612(22)43513(16)23)19(29)2420(32)262518(28)11810(21)6714(11)302h38H12H3(H2528)(H224262932)
MFCD01963091
N(((5CHLORO2METHOXYBENZOYL)AMINO)CARBAMOTHIOYL)3(26DICHLOROPHENYL)5METHYL12OXAZOLE4CARBOXAMIDE
N((2((5chloro2methoxyphenyl)carbonyl)hydrazinyl)carbonothioyl)3(26dichlorophenyl)5methyl12oxazole4carboxamide
N((2(5CHLORO2METHOXYBENZOYL)HYDRAZINYL)CARBOTHIOYL)3(26DICHLOROPHENYL)5METHYL12OXAZOLE4CARBOXAMIDE
N(2(5chloro2methoxybenzoyl)hydrazinecarbonothioyl)3(26dichlorophenyl)5methylisoxazole4carboxamide
ZINC000002376352
ZINC02376352
ZINC2376352

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Available files

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