Vitas-M small molecule compound
N-[(2S)-1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-1-oxopropan-2-yl]-2-(1H-pyrrol-1-yl)-1,3-benzothiazole-6-carboxamide
Catalog ID
STK651191
SMILES O=C([C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NCCC1=CCCCC1
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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 C23H26N4O2S MW 422.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S/c1-16(21(28)24-12-11-17-7-3-2-4-8-17)25-22(29)18-9-10-19-20(15-18)30-23(26-19)27-13-5-6-14-27/h5-7,9-10,13-16H,2-4,8,11-12H2,1H3,(H,24,28)(H,25,29)/t16-/m0/s1InChIKey
XWEMXOIYTRYCAO-INIZCTEOSA-NSynonyms
1175756-27-0(S)N(1((2(cyclohex1en1yl)ethyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)benzo(d)thiazole6carboxamide
1175756270
CC(C(=O)NCCC1=CCCCC1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4
InChI=1SC23H26N4O2Sc116(21(28)241211177324817)2522(29)189101920(1518)3023(2619)2713561427h579101316H2481112H21H3(H2428)(H2529)t16m0s1
MFCD18165877
N((2S)1((2(cyclohex1en1yl)ethyl)amino)1oxopropan2yl)2(1Hpyrrol1yl)13benzothiazole6carboxamide
N((2S)1(2(cyclohexen1yl)ethylamino)1oxopropan2yl)2pyrrol1yl13benzothiazole6carboxamide
O=C((C@@H)(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)NCCC1=CCCCC1
ZINC000032070199
ZINC32070199
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