Vitas-M small molecule compound
propan-2-yl 2-{[(2E)-3-(4-bromophenyl)prop-2-enoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK445268
SMILES Brc1ccc(cc1)/C=C/C(=O)Nc1sc2c(c1C(=O)OC(C)C)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 C22H24BrNO3S MW 462.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrNO3S/c1-14(2)27-22(26)20-17-6-4-3-5-7-18(17)28-21(20)24-19(25)13-10-15-8-11-16(23)12-9-15/h8-14H,3-7H2,1-2H3,(H,24,25)/b13-10+InChIKey
NMVRXSAXKPQILI-JLHYYAGUSA-NSynonyms
Brc1ccc(cc1)C=CC(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCCC2
CC(C)OC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C=CC3=CC=C(C=C3)Br
InChI=1SC22H24BrNO3Sc114(2)2722(26)20176435718(17)2821(20)2419(25)13101581116(23)12915h814H37H212H3(H2425)b1310+
MFCD01338351
propan2yl2(((2E)3(4bromophenyl)prop2enoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
propan2yl2(((E)3(4bromophenyl)prop2enoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ZINC000008396344
ZINC08396344
ZINC8396344
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