Vitas-M small molecule compound
N-cyclopropyl-6-ethyl-2-{[(E)-{4-[(4-methylbenzyl)oxy]phenyl}methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK439972
SMILES CCC1CCc2c(C1)sc(c2C(=O)NC1CC1)/N=C/c1ccc(cc1)OCc1ccc(cc1)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 C29H32N2O2S MW 472.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N2O2S/c1-3-20-10-15-25-26(16-20)34-29(27(25)28(32)31-23-11-12-23)30-17-21-8-13-24(14-9-21)33-18-22-6-4-19(2)5-7-22/h4-9,13-14,17,20,23H,3,10-12,15-16,18H2,1-2H3,(H,31,32)/b30-17+InChIKey
RRPSHIMJQTUKPO-OCSSWDANSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)NC3CC3)N=CC4=CC=C(C=C4)OCC5=CC=C(C=C5)C
CCC1CCc2c(C1)sc(c2C(=O)NC1CC1)N=Cc1ccc(cc1)OCc1ccc(cc1)C
InChI=1SC29H32N2O2Sc132010152526(1620)3429(27(25)28(32)3123111223)30172181324(14921)3318226419(2)5722h491314172023H31012151618H212H3(H3132)b3017+
MFCD03946117
Ncyclopropyl6ethyl2(((E)(4((4methylbenzyl)oxy)phenyl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
Ncyclopropyl6ethyl2((E)(4((4methylphenyl)methoxy)phenyl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
ZINC000020562838
ZINC000020562841
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