Vitas-M small molecule compound
N-[(2S)-1-{[(1-ethylpyrrolidin-2-yl)methyl]amino}-1-oxopropan-2-yl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK647833
SMILES CCN1CCCC1CNC(=O)[C@@H](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 C22H27N5O2S MW 425.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2S/c1-3-26-12-6-7-17(26)14-23-20(28)15(2)24-21(29)16-8-9-18-19(13-16)30-22(25-18)27-10-4-5-11-27/h4-5,8-11,13,15,17H,3,6-7,12,14H2,1-2H3,(H,23,28)(H,24,29)/t15-,17?/m0/s1InChIKey
MMCQWVLEAZAZPW-MYJWUSKBSA-NSynonyms
1212467-14-51212467145
CCN1CCCC1CNC(=O)(C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C
CCN1CCCC1CNC(=O)C(C)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
InChI=1SC22H27N5O2Sc1326126717(26)142320(28)15(2)2421(29)16891819(1316)3022(2518)2710451127h45811131517H3671214H212H3(H2328)(H2429)t1517?m0s1
MFCD18164696
N((2S)1(((1ethylpyrrolidin2yl)methyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1(((1ethylpyrrolidin2yl)methyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
N((2S)1((1ethylpyrrolidin2yl)methylamino)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
ZINC000031815238
ZINC000031815243
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