Vitas-M small molecule compound
2-{[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Catalog ID
STK432249
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1sc2c(c1C(=O)N)CCCCC2
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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 C20H22N2O3S MW 370.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O3S/c1-25-14-10-7-13(8-11-14)9-12-17(23)22-20-18(19(21)24)15-5-3-2-4-6-16(15)26-20/h7-12H,2-6H2,1H3,(H2,21,24)(H,22,23)/b12-9+InChIKey
IOLXLIZRPXMYLV-FMIVXFBMSA-NSynonyms
2(((2E)3(4methoxyphenyl)prop2enoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2(((E)3(4methoxyphenyl)prop2enoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
COC1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N
COc1ccc(cc1)C=CC(=O)Nc1sc2c(c1C(=O)N)CCCCC2
InChI=1SC20H22N2O3Sc1251410713(81114)91217(23)222018(19(21)24)155324616(15)2620h712H26H21H3(H22124)(H2223)b129+
MFCD03383931
ZINC000001111753
ZINC01111753
ZINC1111753
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