Vitas-M small molecule compound
ethyl {10-[N-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-beta-alanyl]-10H-phenothiazin-2-yl}carbamate
Catalog ID
STK527989
SMILES CCOC(=O)Nc1ccc2c(c1)N(C(=O)CCNC13CC4CC(C3)CC(C1)C4)c1c(S2)cccc1
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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 C28H33N3O3S MW 491.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O3S/c1-2-34-27(33)30-21-7-8-25-23(14-21)31(22-5-3-4-6-24(22)35-25)26(32)9-10-29-28-15-18-11-19(16-28)13-20(12-18)17-28/h3-8,14,18-20,29H,2,9-13,15-17H2,1H3,(H,30,33)InChIKey
LYKXBCLPTBVDCQ-UHFFFAOYSA-NSynonyms
CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CCNC45CC6CC(C4)CC(C6)C5
CCOC(=O)Nc1ccc2c(c1)N(C(=O)CCNC13CC4CC(C3)CC(C1)C4)c1c(S2)cccc1Cl
ethyl(10(3((3s5s7s)adamantan1ylamino)propanoyl)10Hphenothiazin2yl)carbamatehydrochloride
ethyl(10(N(tricyclo(3311~37~)dec1yl)betaalanyl)10Hphenothiazin2yl)carbamate
ETHYLN(10(3(1ADAMANTYLAMINO)PROPANOYL)PHENOTHIAZIN2YL)CARBAMATE
InChI=1SC28H33N3O3Sc123427(33)3021782523(1421)31(22534624(22)3525)26(32)910292815181119(1628)1320(1218)1728h3814182029H29131517H21H3(H3033)
MFCD01874873
ZINC000009007739
ZINC9007739
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