Vitas-M small molecule compound

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

Catalog ID
STK072472
SMILES O=C(Nc1nnc(s1)SCC(=O)Nc1cccc(c1)C)CCc1ccccc1

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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 C20H20N4O2S2 MW 412.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S2/c1-14-6-5-9-16(12-14)21-18(26)13-27-20-24-23-19(28-20)22-17(25)11-10-15-7-3-2-4-8-15/h2-9,12H,10-11,13H2,1H3,(H,21,26)(H,22,23,25)
InChIKey
JEPNMGFUCMJPSL-UHFFFAOYSA-N
Synonyms
477212-50-3
477212503
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3
InChI=1SC20H20N4O2S2c11465916(1214)2118(26)132720242319(2820)2217(25)1110157324815h2912H101113H21H3(H2126)(H222325)
MFCD03356312
N((2E)5((2((3METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)134THIADIAZOL2(3H)YLIDENE)3PHENYLPROPANAMIDE
N(5((2((3METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)134THIADIAZOL2YL)3PHENYLPROPANAMIDE
N(5((2OXO2(3TOLUIDINO)ETHYL)SULFANYL)134THIADIAZOL2YL)3PHENYLPROPANAMIDE
N(5((2oxo2(mtolylamino)ethyl)thio)134thiadiazol2yl)3phenylpropanamide
N(5(2(3METHYLANILINO)2OXOETHYL)SULFANYL134THIADIAZOL2YL)3PHENYLPROPANAMIDE
O=C(Nc1nnc(s1)SCC(=O)Nc1cccc(c1)C)CCc1ccccc1
STK072472
ZINC04599811
ZINC4599811

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Available files

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