Vitas-M small molecule compound

Catalog ID
STK612060
SMILES CCC([C@@H](C(=O)N1CCN(CC1)C)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1)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 C22H30N4O3S MW 430.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N4O3S/c1-4-14(2)18(21(29)25-11-9-24(3)10-12-25)23-19(27)17-13-30-22-16-8-6-5-7-15(16)20(28)26(17)22/h5-8,14,17-18,22H,4,9-13H2,1-3H3,(H,23,27)/t14?,17-,18-,22?/m0/s1
InChIKey
DYETYILBGCWBFC-XDPRBKCFSA-N
Synonyms
1013982-26-7
(3R)N((2S)3methyl1(4methylpiperazin1yl)1oxopentan2yl)5oxo39bdihydro2H(13)thiazolo(23a)isoindole3carboxamide
(3R)N((2S3R)3methyl1(4methylpiperazin1yl)1oxopentan2yl)5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
1013982267
CCC((C@@H)(C(=O)N1CCN(CC1)C)NC(=O)(C@@H)1CSC2N1C(=O)c1c2cccc1)C
CCC(C)C(C(=O)N1CCN(CC1)C)NC(=O)C2CSC3N2C(=O)C4=CC=CC=C34
InChI=1SC22H30N4O3Sc1414(2)18(21(29)2511924(3)101225)2319(27)1713302216865715(16)20(28)26(17)22h5814171822H4913H213H3(H2327)t14?171822?m0s1
MFCD06781318
ZINC000013557307
ZINC000013557314

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Available files

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