Vitas-M small molecule compound
methyl 2-{[(2E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK425997
SMILES COC(=O)c1c(NC(=O)/C=C/c2ccc(o2)C)sc2c1CCCCC2
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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 C19H21NO4S MW 359.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO4S/c1-12-8-9-13(24-12)10-11-16(21)20-18-17(19(22)23-2)14-6-4-3-5-7-15(14)25-18/h8-11H,3-7H2,1-2H3,(H,20,21)/b11-10+InChIKey
DJQFXFVNFWZDSK-ZHACJKMWSA-NSynonyms
CC1=CC=C(O1)C=CC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OC
COC(=O)c1c(NC(=O)C=Cc2ccc(o2)C)sc2c1CCCCC2
InChI=1SC19H21NO4Sc1128913(2412)101116(21)201817(19(22)232)146435715(14)2518h811H37H212H3(H2021)b1110+
methyl2(((2E)3(5methylfuran2yl)prop2enoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2(((E)3(5methylfuran2yl)prop2enoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01336726
ZINC000000994991
ZINC00994991
ZINC994991
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