Vitas-M small molecule compound

N-(5-chloro-2-methylphenyl)-N'-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide

Catalog ID
STL055107
SMILES CC(Cc1n[nH]/c(=N\C(=O)CCC(=O)Nc2cc(Cl)ccc2C)/s1)C

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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 C17H21ClN4O2S MW 380.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21ClN4O2S/c1-10(2)8-16-21-22-17(25-16)20-15(24)7-6-14(23)19-13-9-12(18)5-4-11(13)3/h4-5,9-10H,6-8H2,1-3H3,(H,19,23)(H,20,22,24)
InChIKey
VXXNMDVTKWEQBG-UHFFFAOYSA-N
Synonyms
714945-10-5
714945105
CC(Cc1n(nH)c(=NC(=O)CCC(=O)Nc2cc(Cl)ccc2C)s1)C
CC1=C(C=C(C=C1)Cl)NC(=O)CCC(=O)NC2=NN=C(S2)CC(C)C
InChI=1SC17H21ClN4O2Sc110(2)816212217(2516)2015(24)7614(23)1913912(18)5411(13)3h45910H68H213H3(H1923)(H202224)
MFCD05737046
N(5chloro2methylphenyl)N((2E)5(2methylpropyl)134thiadiazol2(3H)ylidene)butanediamide
N(5CHLORO2METHYLPHENYL)N(5(2METHYLPROPYL)134THIADIAZOL2YL)BUTANEDIAMIDE
ZINC000002448614
ZINC02448614
ZINC2448614

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Available files

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