Vitas-M small molecule compound

methyl 2-{[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK804635
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1sc2c(c1C(=O)OC)CCC2

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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 C19H19NO4S MW 357.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO4S/c1-23-13-9-6-12(7-10-13)8-11-16(21)20-18-17(19(22)24-2)14-4-3-5-15(14)25-18/h6-11H,3-5H2,1-2H3,(H,20,21)/b11-8+
InChIKey
QREFLTWXDHOILR-DHZHZOJOSA-N
Synonyms
302803-13-0
(E)methyl2(3(4methoxyphenyl)acrylamido)56dihydro4Hcyclopenta(b)thiophene3carboxylate
302803130
COC1=CC=C(C=C1)C=CC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC
COc1ccc(cc1)C=CC(=O)Nc1sc2c(c1C(=O)OC)CCC2
InChI=1SC19H19NO4Sc123139612(71013)81116(21)201817(19(22)242)1443515(14)2518h611H35H212H3(H2021)b118+
methyl2(((2E)3(4methoxyphenyl)prop2enoyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2(((E)3(4METHOXYPHENYL)PROP2ENOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2((2E)3(4METHOXYPHENYL)PROP2ENOYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
MFCD02080817
ZINC000038925781
ZINC38925781

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.