Vitas-M small molecule compound
(2Z)-2-cyano-3-[1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-N-(3-ethoxyphenyl)prop-2-enamide
Catalog ID
STK186485
SMILES CCOc1cccc(c1)NC(=O)/C(=C\c1cc(n(c1C)c1sc2c(c1C#N)CCCC2)C)/C#N
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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 C27H26N4O2S MW 470.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O2S/c1-4-33-22-9-7-8-21(14-22)30-26(32)20(15-28)13-19-12-17(2)31(18(19)3)27-24(16-29)23-10-5-6-11-25(23)34-27/h7-9,12-14H,4-6,10-11H2,1-3H3,(H,30,32)/b20-13-InChIKey
YRGNBAAHTDRHTJ-MOSHPQCFSA-NSynonyms
(2Z)2cyano3(1(3cyano4567tetrahydro1benzothiophen2yl)25dimethyl1Hpyrrol3yl)N(3ethoxyphenyl)prop2enamide
(Z)2cyano3(1(3cyano4567tetrahydro1benzothiophen2yl)25dimethylpyrrol3yl)N(3ethoxyphenyl)prop2enamide
(Z)2cyano3(1(3cyano4567tetrahydrobenzo(b)thiophen2yl)25dimethyl1Hpyrrol3yl)N(3ethoxyphenyl)acrylamide
CCOC1=CC=CC(=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3=C(C4=C(S3)CCCC4)C#N)C)C#N
CCOc1cccc(c1)NC(=O)C(=Cc1cc(n(c1C)c1sc2c(c1C#N)CCCC2)C)C#N
InChI=1SC27H26N4O2Sc14332297821(1422)3026(32)20(1528)13191217(2)31(18(19)3)2724(1629)2310561125(23)3427h791214H461011H213H3(H3032)b2013
MFCD01909685
ZINC000009907435
ZINC09907435
ZINC9907435
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