Vitas-M small molecule compound
1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[(2S)-4-(methylsulfanyl)-1-oxo-1-(prop-2-en-1-ylamino)butan-2-yl]piperidine-4-carboxamide
Catalog ID
STK601412
SMILES CSCC[C@@H](C(=O)NCC=C)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2
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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 C20H27N5O4S3 MW 497.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O4S3/c1-3-10-21-20(27)16(9-13-30-2)22-19(26)14-7-11-25(12-8-14)32(28,29)17-6-4-5-15-18(17)24-31-23-15/h3-6,14,16H,1,7-13H2,2H3,(H,21,27)(H,22,26)/t16-/m0/s1InChIKey
FFNXIIIBLKLGPF-INIZCTEOSA-NSynonyms
956382-45-9(S)N(1(allylamino)4(methylthio)1oxobutan2yl)1(benzo(c)(125)thiadiazol4ylsulfonyl)piperidine4carboxamide
1(213benzothiadiazol4ylsulfonyl)N((2S)4(methylsulfanyl)1oxo1(prop2en1ylamino)butan2yl)piperidine4carboxamide
1(213benzothiadiazol4ylsulfonyl)N((2S)4methylsulfanyl1oxo1(prop2enylamino)butan2yl)piperidine4carboxamide
956382459
CSCC(C@@H)(C(=O)NCC=C)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2
CSCCC(C(=O)NCC=C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32
InChI=1SC20H27N5O4S3c13102120(27)16(913302)2219(26)1471125(12814)32(2829)176451518(17)24312315h361416H1713H22H3(H2127)(H2226)t16m0s1
MFCD08743546
ZINC000009134362
ZINC09134362
ZINC9134362
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