Vitas-M small molecule compound
N-[(2S)-1-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-3-methyl-1-oxobutan-2-yl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK647154
SMILES CCN1CCCC1CNC(=O)[C@H](C(C)C)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1
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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 C24H31N5O2S MW 453.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N5O2S/c1-4-28-13-7-8-18(28)15-25-23(31)21(16(2)3)27-22(30)17-9-10-19-20(14-17)32-24(26-19)29-11-5-6-12-29/h5-6,9-12,14,16,18,21H,4,7-8,13,15H2,1-3H3,(H,25,31)(H,27,30)/t18?,21-/m0/s1InChIKey
KLJUFHBTLRMBAE-ZYZRXSCRSA-NSynonyms
1212463-44-91212463449
CCN1CCCC1CNC(=O)(C@H)(C(C)C)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1
CCN1CCCC1CNC(=O)C(C(C)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
InChI=1SC24H31N5O2Sc1428137818(28)152523(31)21(16(2)3)2722(30)179101920(1417)3224(2619)2911561229h5691214161821H4781315H213H3(H2531)(H2730)t18?21m0s1
MFCD18164472
N((2S)1(((1ethylpyrrolidin2yl)methyl)amino)3methyl1oxobutan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1(((1ethylpyrrolidin2yl)methyl)amino)3methyl1oxobutan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
N((2S)1((1ethylpyrrolidin2yl)methylamino)3methyl1oxobutan2yl)2pyrrol1yl13benzothiazole6carboxamide
ZINC000012321369
ZINC000012321370
Check stock
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Check stock on Vitas-MAvailable files
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