Vitas-M small molecule compound

N-{(2S)-1-[(1-benzylpiperidin-4-yl)amino]-1-oxopropan-2-yl}-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide

Catalog ID
STK647944
SMILES O=C([C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NC1CCN(CC1)Cc1ccccc1

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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 C27H29N5O2S MW 487.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S/c1-19(25(33)29-22-11-15-31(16-12-22)18-20-7-3-2-4-8-20)28-26(34)21-9-10-23-24(17-21)35-27(30-23)32-13-5-6-14-32/h2-10,13-14,17,19,22H,11-12,15-16,18H2,1H3,(H,28,34)(H,29,33)/t19-/m0/s1
InChIKey
TYAKJXCWMDHVCH-IBGZPJMESA-N
Synonyms
1212076-68-0
(S)N(1((1benzylpiperidin4yl)amino)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
1212076680
CC(C(=O)NC1CCN(CC1)CC2=CC=CC=C2)NC(=O)C3=CC4=C(C=C3)N=C(S4)N5C=CC=C5
InChI=1SC27H29N5O2Sc119(25(33)2922111531(161222)18207324820)2826(34)219102324(1721)3527(3023)3213561432h2101314171922H1112151618H21H3(H2834)(H2933)t19m0s1
MFCD18164735
N((2S)1((1benzylpiperidin4yl)amino)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1((1benzylpiperidin4yl)amino)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
O=C((C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NC1CCN(CC1)Cc1ccccc1
ZINC000032074961
ZINC32074961

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Available files

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