Vitas-M small molecule compound
ethyl 2-{[(2E)-2-cyano-3-{3-[(4-ethylphenoxy)methyl]-4-methoxyphenyl}prop-2-enoyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate
Catalog ID
STK474099
SMILES CCOC(=O)c1cc(sc1NC(=O)/C(=C/c1ccc(c(c1)COc1ccc(cc1)CC)OC)/C#N)C(C)C
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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 C30H32N2O5S MW 532.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O5S/c1-6-20-8-11-24(12-9-20)37-18-23-15-21(10-13-26(23)35-5)14-22(17-31)28(33)32-29-25(30(34)36-7-2)16-27(38-29)19(3)4/h8-16,19H,6-7,18H2,1-5H3,(H,32,33)/b22-14+InChIKey
KTKQMKHPWAAURS-HYARGMPZSA-NSynonyms
CCC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=C(C#N)C(=O)NC3=C(C=C(S3)C(C)C)C(=O)OCC)OC
CCOC(=O)c1cc(sc1NC(=O)C(=Cc1ccc(c(c1)COc1ccc(cc1)CC)OC)C#N)C(C)C
ethyl2(((2E)2cyano3(3((4ethylphenoxy)methyl)4methoxyphenyl)prop2enoyl)amino)5(propan2yl)thiophene3carboxylate
ethyl2(((E)2cyano3(3((4ethylphenoxy)methyl)4methoxyphenyl)prop2enoyl)amino)5propan2ylthiophene3carboxylate
ETHYL2((2E)2CYANO3(3((4ETHYLPHENOXY)METHYL)4METHOXYPHENYL)PROP2ENOYLAMINO)5(METHYLETHYL)THIOPHENE3CARBOXYLATE
InChI=1SC30H32N2O5Sc162081124(12920)3718231521(101326(23)355)1422(1731)28(33)322925(30(34)3672)1627(3829)19(3)4h81619H6718H215H3(H3233)b2214+
MFCD07093597
ZINC000097965830
ZINC97965830
Check stock
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Check stock on Vitas-MAvailable files
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