Vitas-M small molecule compound

methyl {10-[3-(hexahydropyrrolo[1,2-a]pyrazin-2(1H)-yl)propanoyl]-10H-phenothiazin-2-yl}carbamate

Catalog ID
STL324493
SMILES COC(=O)Nc1ccc2c(c1)N(C(=O)CCN1CCN3C(C1)CCC3)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 C24H28N4O3S MW 452.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O3S/c1-31-24(30)25-17-8-9-22-20(15-17)28(19-6-2-3-7-21(19)32-22)23(29)10-12-26-13-14-27-11-4-5-18(27)16-26/h2-3,6-9,15,18H,4-5,10-14,16H2,1H3,(H,25,30)
InChIKey
PHIBDVLPQXJYJA-UHFFFAOYSA-N
Synonyms

COC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CCN4CCN5CCCC5C4
COC(=O)Nc1ccc2c(c1)N(C(=O)CCN1CCN3C(C1)CCC3)c1c(S2)cccc1ClCl
InChI=1SC24H28N4O3Sc13124(30)2517892220(1517)28(19623721(19)3222)23(29)101226131427114518(27)1626h23691518H45101416H21H3(H2530)
methyl(10(3(hexahydropyrrolo(12a)pyrazin2(1H)yl)propanoyl)10Hphenothiazin2yl)carbamate
methyl(10(3(hexahydropyrrolo(12a)pyrazin2(1H)yl)propanoyl)10Hphenothiazin2yl)carbamatedihydrochloride
methylN(10(3(346788ahexahydro1Hpyrrolo(12a)pyrazin2yl)propanoyl)phenothiazin2yl)carbamate
MFCD01533871
ZINC000000983745
ZINC000019593644

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Available files

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