Vitas-M small molecule compound
N-benzyl-2-{[3-(3-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanamide
Catalog ID
STK720752
SMILES Cc1cccc(c1)n1c(SC(C(=O)NCc2ccccc2)C)nc2c(c1=O)c1CCCCc1s2
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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 C27H27N3O2S2 MW 489.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2S2/c1-17-9-8-12-20(15-17)30-26(32)23-21-13-6-7-14-22(21)34-25(23)29-27(30)33-18(2)24(31)28-16-19-10-4-3-5-11-19/h3-5,8-12,15,18H,6-7,13-14,16H2,1-2H3,(H,28,31)InChIKey
WNMDJMRUZVVOHK-UHFFFAOYSA-NSynonyms
371141-06-9371141069
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SC(C)C(=O)NCC4=CC=CC=C4)SC5=C3CCCC5
InChI=1SC27H27N3O2S2c117981220(1517)3026(32)232113671422(21)3425(23)2927(30)3318(2)24(31)281619104351119h358121518H67131416H212H3(H2831)
MFCD03008909
Nbenzyl2((3(3methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)propanamide
Nbenzyl2((3(3methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)propanamide
Nbenzyl2((4oxo3(mtolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)propanamide
ZINC000002314647
ZINC000002314648
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