Vitas-M small molecule compound

4-methyl-N-[5-(prop-2-en-1-ylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-(pyrrolidin-1-ylsulfonyl)benzamide

Catalog ID
STK807552
SMILES C=CCSc1nnc(s1)NC(=O)c1ccc(c(c1)S(=O)(=O)N1CCCC1)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 C17H20N4O3S3 MW 424.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O3S3/c1-3-10-25-17-20-19-16(26-17)18-15(22)13-7-6-12(2)14(11-13)27(23,24)21-8-4-5-9-21/h3,6-7,11H,1,4-5,8-10H2,2H3,(H,18,19,22)
InChIKey
GFTLSYKDUNCKNA-UHFFFAOYSA-N
Synonyms
690246-79-8
(4METHYL3(PYRROLIDINYLSULFONYL)PHENYL)N(5PROP2ENYLTHIO(134THIADIAZOL2YL))CARBOXAMIDE
4methylN(5(prop2en1ylsulfanyl)134thiadiazol2yl)3(pyrrolidin1ylsulfonyl)benzamide
4METHYLN(5PROP2ENYLSULFANYL134THIADIAZOL2YL)3PYRROLIDIN1YLSULFONYLBENZAMIDE
690246798
CC1=C(C=C(C=C1)C(=O)NC2=NN=C(S2)SCC=C)S(=O)(=O)N3CCCC3
InChI=1SC17H20N4O3S3c13102517201916(2617)1815(22)137612(2)14(1113)27(2324)21845921h36711H145810H22H3(H181922)
MFCD04445526
N(5(ALLYLTHIO)134THIADIAZOL2YL)4METHYL3(PYRROLIDIN1YLSULFONYL)BENZAMIDE
ZINC000009971568
ZINC09971568
ZINC9971568

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Available files

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