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ethyl (2E)-2-({1-[2-(4-tert-butylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-3-oxo-7-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL440433
SMILES CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)/c(=C\c1cn(c3c1cccc3)CCOc1ccc(cc1)C(C)(C)C)/s2)c1ccccc1

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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 C40H37N3O4S2 MW 687.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H37N3O4S2/c1-5-46-38(45)34-35(26-12-7-6-8-13-26)41-39-43(36(34)32-16-11-23-48-32)37(44)33(49-39)24-27-25-42(31-15-10-9-14-30(27)31)21-22-47-29-19-17-28(18-20-29)40(2,3)4/h6-20,23-25,36H,5,21-22H2,1-4H3/b33-24+
InChIKey
UXVVGDFAJWPRNM-IWBSIUBASA-N
Synonyms

CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)c(=Cc1cn(c3c1cccc3)CCOc1ccc(cc1)C(C)(C)C)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CN(C5=CC=CC=C54)CCOC6=CC=C(C=C6)C(C)(C)C)S2)C7=CC=CC=C7
ethyl(2E)2((1(2(4tertbutylphenoxy)ethyl)1Hindol3yl)methylidene)3oxo7phenyl5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2((1(2(4tertbutylphenoxy)ethyl)indol3yl)methylidene)3oxo7phenyl5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC40H37N3O4S2c154638(45)3435(26127681326)413943(36(34)321611234832)37(44)33(4939)24272542(31151091430(27)31)21224729191728(182029)40(23)4h620232536H52122H214H3b3324+
MFCD02195973
ZINC000150342451
ZINC000150342453

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Available files

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