Vitas-M small molecule compound

N-[(2Z)-5-butyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-propyl-2-(1H-pyrrol-1-yl)-1,3-thiazole-5-carboxamide

Catalog ID
STL154132
SMILES CCCCc1n[nH]/c(=N/C(=O)c2sc(nc2CCC)n2cccc2)/s1

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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 C17H21N5OS2 MW 375.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5OS2/c1-3-5-9-13-20-21-16(24-13)19-15(23)14-12(8-4-2)18-17(25-14)22-10-6-7-11-22/h6-7,10-11H,3-5,8-9H2,1-2H3,(H,19,21,23)
InChIKey
PKDLERFVFMGTES-UHFFFAOYSA-N
Synonyms
1246071-70-4
1246071704
CCCCC1=NN=C(S1)NC(=O)C2=C(N=C(S2)N3C=CC=C3)CCC
CCCCc1n(nH)c(=NC(=O)c2sc(nc2CCC)n2cccc2)s1
InChI=1SC17H21N5OS2c135913202116(2413)1915(23)1412(842)1817(2514)2210671122h671011H3589H212H3(H192123)
MFCD20756898
N((2Z)5butyl134thiadiazol2(3H)ylidene)4propyl2(1Hpyrrol1yl)13thiazole5carboxamide
N(5butyl134thiadiazol2yl)4propyl2pyrrol1yl13thiazole5carboxamide
ZINC000049547245
ZINC49547245

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Available files

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