Vitas-M small molecule compound
N-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
Catalog ID
STK301399
SMILES N#Cc1c(NC(=S)NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)OCC(C)C)sc2c1CCCC2
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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 C30H28N4O2S2 MW 540.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N4O2S2/c1-18(2)17-36-20-9-7-8-19(14-20)26-15-23(21-10-3-5-12-25(21)32-26)28(35)33-30(37)34-29-24(16-31)22-11-4-6-13-27(22)38-29/h3,5,7-10,12,14-15,18H,4,6,11,13,17H2,1-2H3,(H2,33,34,35,37)InChIKey
BPFNAWQVYLHPAU-UHFFFAOYSA-NSynonyms
438195-78-9438195789
CC(C)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=C(C5=C(S4)CCCC5)C#N
InChI=1SC30H28N4O2S2c118(2)17362097819(1420)261523(2110351225(21)3226)28(35)3330(37)342924(1631)2211461327(22)3829h3571012141518H46111317H212H3(H233343537)
MFCD03073848
N((3cyano4567tetrahydro1benzothiophen2yl)carbamothioyl)2(3(2methylpropoxy)phenyl)quinoline4carboxamide
ZINC000002777341
ZINC02777341
ZINC2777341
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