Vitas-M small molecule compound
N-{1-oxo-1-[(2Z)-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylideneamino]propan-2-yl}-4-(pyridin-2-yl)piperazine-1-carboxamide
Catalog ID
STL158728
SMILES O=C(C(NC(=O)N1CCN(CC1)c1ccccn1)C)/N=c/1\sc2c([nH]1)CCCC2
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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 C20H26N6O2S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N6O2S/c1-14(18(27)24-19-23-15-6-2-3-7-16(15)29-19)22-20(28)26-12-10-25(11-13-26)17-8-4-5-9-21-17/h4-5,8-9,14H,2-3,6-7,10-13H2,1H3,(H,22,28)(H,23,24,27)InChIKey
SEAPZPSHVSPJRB-UHFFFAOYSA-NSynonyms
CC(C(=O)NC1=NC2=C(S1)CCCC2)NC(=O)N3CCN(CC3)C4=CC=CC=N4
InChI=1SC20H26N6O2Sc114(18(27)24192315623716(15)2919)2220(28)26121025(111326)1784592117h458914H23671013H21H3(H2228)(H232427)
MFCD20758442
N(1oxo1((2Z)4567tetrahydro13benzothiazol2(3H)ylideneamino)propan2yl)4(pyridin2yl)piperazine1carboxamide
N(1oxo1(4567tetrahydro13benzothiazol2ylamino)propan2yl)4pyridin2ylpiperazine1carboxamide
O=C(C(NC(=O)N1CCN(CC1)c1ccccn1)C)N=c1sc2c((nH)1)CCCC2
ZINC000061720586
ZINC000071333717
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