Vitas-M small molecule compound
2-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-N-(3,4-dimethylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL367623
SMILES O=C(c1c(/N=C/c2ccc3c(c2)OCO3)sc2c1CCCC2)Nc1ccc(c(c1)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 C25H24N2O3S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O3S/c1-15-7-9-18(11-16(15)2)27-24(28)23-19-5-3-4-6-22(19)31-25(23)26-13-17-8-10-20-21(12-17)30-14-29-20/h7-13H,3-6,14H2,1-2H3,(H,27,28)/b26-13+InChIKey
RCUVLSYRXVVRLZ-LGJNPRDNSA-NSynonyms
2(((E)13benzodioxol5ylmethylidene)amino)N(34dimethylphenyl)4567tetrahydro1benzothiophene3carboxamide
2((E)13benzodioxol5ylmethylideneamino)N(34dimethylphenyl)4567tetrahydro1benzothiophene3carboxamide
CC1=C(C=C(C=C1)NC(=O)C2=C(SC3=C2CCCC3)N=CC4=CC5=C(C=C4)OCO5)C
InChI=1SC25H24N2O3Sc1157918(1116(15)2)2724(28)2319534622(19)3125(23)2613178102021(1217)30142920h713H3614H212H3(H2728)b2613+
MFCD28951867
O=C(c1c(N=Cc2ccc3c(c2)OCO3)sc2c1CCCC2)Nc1ccc(c(c1)C)C
ZINC000098086344
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