Vitas-M small molecule compound
N-{(2S)-3-methyl-1-oxo-1-[(pyridin-3-ylmethyl)amino]pentan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK652271
SMILES CC[C@@H]([C@@H](C(=O)NCc1cccnc1)NC(=O)c1ccc2c(c1)sc(n2)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 C24H25N5O2S MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O2S/c1-3-16(2)21(23(31)26-15-17-7-6-10-25-14-17)28-22(30)18-8-9-19-20(13-18)32-24(27-19)29-11-4-5-12-29/h4-14,16,21H,3,15H2,1-2H3,(H,26,31)(H,28,30)/t16-,21-/m0/s1InChIKey
HXWKSCDWFYEPNF-KKSFZXQISA-NSynonyms
1175976-47-21175976472
CC(C@@H)((C@@H)(C(=O)NCc1cccnc1)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C
CCC(C)C(C(=O)NCC1=CN=CC=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
InChI=1SC24H25N5O2Sc1316(2)21(23(31)2615177610251417)2822(30)18891920(1318)3224(2719)2911451229h4141621H315H212H3(H2631)(H2830)t1621m0s1
MFCD18166274
N((2S)3methyl1oxo1((pyridin3ylmethyl)amino)pentan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S3S)3methyl1oxo1((pyridin3ylmethyl)amino)pentan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
N((2S3S)3methyl1oxo1(pyridin3ylmethylamino)pentan2yl)2pyrrol1yl13benzothiazole6carboxamide
ZINC000031817559
ZINC31817559
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