Vitas-M small molecule compound
tert-butyl 4-(2-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-2-oxoethyl)-1,4-diazepane-1-carboxylate
Catalog ID
STL167955
SMILES COC(=O)c1sccc1NC(=O)CN1CCCN(CC1)C(=O)OC(C)(C)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 C18H27N3O5S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O5S/c1-18(2,3)26-17(24)21-8-5-7-20(9-10-21)12-14(22)19-13-6-11-27-15(13)16(23)25-4/h6,11H,5,7-10,12H2,1-4H3,(H,19,22)InChIKey
HENIODPDXLIFDE-UHFFFAOYSA-NSynonyms
CC(C)(C)OC(=O)N1CCCN(CC1)CC(=O)NC2=C(SC=C2)C(=O)OC
InChI=1SC18H27N3O5Sc118(23)2617(24)2185720(91021)1214(22)19136112715(13)16(23)254h611H571012H214H3(H1922)
MFCD20754780
tertbutyl4(2((2(methoxycarbonyl)thiophen3yl)amino)2oxoethyl)14diazepane1carboxylate
tertbutyl4(2((2methoxycarbonylthiophen3yl)amino)2oxoethyl)14diazepane1carboxylate
ZINC000071775386
ZINC71775386
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