Vitas-M small molecule compound

(2E)-2-({5-[(3-chloro-4-fluorophenoxy)methyl]furan-2-yl}methylidene)-7-methyl-N-(2-methylphenyl)-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide

Catalog ID
STL176595
SMILES O=C(C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1ccc(o1)COc1ccc(c(c1)Cl)F)/s2)Nc1ccccc1C

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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 C31H23ClFN3O4S2 MW 620.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23ClFN3O4S2/c1-17-6-3-4-7-24(17)35-29(37)27-18(2)34-31-36(28(27)25-8-5-13-41-25)30(38)26(42-31)15-20-9-10-21(40-20)16-39-19-11-12-23(33)22(32)14-19/h3-15,28H,16H2,1-2H3,(H,35,37)/b26-15+
InChIKey
YDWOIRZYDYVPPT-CVKSISIWSA-N
Synonyms
828272-85-1
(2E)2((5((3chloro4fluorophenoxy)methyl)furan2yl)methylidene)7methylN(2methylphenyl)3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2((5((3chloro4fluorophenoxy)methyl)furan2yl)methylidene)7methylN(2methylphenyl)3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxamide
828272851
CC1=CC=CC=C1NC(=O)C2=C(N=C3N(C2C4=CC=CS4)C(=O)C(=CC5=CC=C(O5)COC6=CC(=C(C=C6)F)Cl)S3)C
InChI=1SC31H23ClFN3O4S2c117634724(17)3529(37)2718(2)343136(28(27)2585134125)30(38)26(4231)152091021(4020)163919111223(33)22(32)1419h31528H16H212H3(H3537)b2615+
MFCD04049699
O=C(C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccc(o1)COc1ccc(c(c1)Cl)F)s2)Nc1ccccc1C
ZINC000102442223
ZINC000102442227

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Available files

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