Vitas-M small molecule compound
6-tert-butyl-2-{[(E)-(4-fluorophenyl)methylidene]amino}-N-(4-methoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK385138
SMILES COc1ccc(cc1)NC(=O)c1c(/N=C/c2ccc(cc2)F)sc2c1CCC(C2)C(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 C27H29FN2O2S MW 464.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29FN2O2S/c1-27(2,3)18-7-14-22-23(15-18)33-26(29-16-17-5-8-19(28)9-6-17)24(22)25(31)30-20-10-12-21(32-4)13-11-20/h5-6,8-13,16,18H,7,14-15H2,1-4H3,(H,30,31)/b29-16+InChIKey
YFPRXPUYHBNUGZ-MUFRIFMGSA-NSynonyms
6tertbutyl2(((E)(4fluorophenyl)methylidene)amino)N(4methoxyphenyl)4567tetrahydro1benzothiophene3carboxamide
6tertbutyl2((E)(4fluorophenyl)methylideneamino)N(4methoxyphenyl)4567tetrahydro1benzothiophene3carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=C(C=C3)OC)N=CC4=CC=C(C=C4)F
COc1ccc(cc1)NC(=O)c1c(N=Cc2ccc(cc2)F)sc2c1CCC(C2)C(C)(C)C
InChI=1SC27H29FN2O2Sc127(23)187142223(1518)3326(2916175819(28)9617)24(22)25(31)3020101221(324)131120h568131618H71415H214H3(H3031)b2916+
MFCD03274019
ZINC000015946433
ZINC000015946435
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