Vitas-M small molecule compound

N-[5-({2-[(2-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide

Catalog ID
STK138481
SMILES COc1ccc(cc1)C(=O)Nc1nnc(s1)SCC(=O)Nc1ccccc1Cl

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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 C18H15ClN4O3S2 MW 434.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN4O3S2/c1-26-12-8-6-11(7-9-12)16(25)21-17-22-23-18(28-17)27-10-15(24)20-14-5-3-2-4-13(14)19/h2-9H,10H2,1H3,(H,20,24)(H,21,22,25)
InChIKey
HNCYZPVCKBFJJX-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3Cl
InChI=1SC18H15ClN4O3S2c126128611(7912)16(25)2117222318(2817)271015(24)2014532413(14)19h29H10H21H3(H2024)(H212225)
MFCD04092422
N(2CHLOROPHENYL)2(5((4METHOXYPHENYL)CARBONYLAMINO)(134THIADIAZOL2YLTHIO))ACETAMIDE
N(5((2((2CHLOROPHENYL)AMINO)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)4METHOXYBENZAMIDE
N(5((2(2CHLOROANILINO)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)4METHOXYBENZAMIDE
N(5(2(2CHLOROANILINO)2OXOETHYL)SULFANYL134THIADIAZOL2YL)4METHOXYBENZAMIDE
ZINC000000624738
ZINC00624738
ZINC624738

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Available files

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