Vitas-M small molecule compound

Catalog ID
STK612933
SMILES CCC([C@@H](C(=O)NC1CC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2)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 C21H29N5O4S2 MW 479.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O4S2/c1-3-13(2)18(21(28)22-15-7-8-15)23-20(27)14-9-11-26(12-10-14)32(29,30)17-6-4-5-16-19(17)25-31-24-16/h4-6,13-15,18H,3,7-12H2,1-2H3,(H,22,28)(H,23,27)/t13?,18-/m0/s1
InChIKey
RPOOVXMEPVVAQF-UWBLVGDVSA-N
Synonyms
956145-35-0
1(213benzothiadiazol4ylsulfonyl)N((2S)1(cyclopropylamino)3methyl1oxopentan2yl)piperidine4carboxamide
1(benzo(c)(125)thiadiazol4ylsulfonyl)N((2S3R)1(cyclopropylamino)3methyl1oxopentan2yl)piperidine4carboxamide
956145350
CCC((C@@H)(C(=O)NC1CC1)NC(=O)C1CCN(CC1)S(=O)(=O)c1cccc2c1nsn2)C
CCC(C)C(C(=O)NC1CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43
InChI=1SC21H29N5O4S2c1313(2)18(21(28)22157815)2320(27)1491126(121014)32(2930)176451619(17)25312416h46131518H3712H212H3(H2228)(H2327)t13?18m0s1
ZINC000009306346
ZINC000013627212

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Available files

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