Vitas-M small molecule compound

benzyl (2E)-2-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK813409
SMILES Clc1ccccc1c1ccc(o1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OCc1ccccc1)C

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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 C30H21ClN2O4S2 MW 573.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21ClN2O4S2/c1-18-26(29(35)36-17-19-8-3-2-4-9-19)27(24-12-7-15-38-24)33-28(34)25(39-30(33)32-18)16-20-13-14-23(37-20)21-10-5-6-11-22(21)31/h2-16,27H,17H2,1H3/b25-16+
InChIKey
DNWZRMIAFCILSX-PCLIKHOPSA-N
Synonyms
617696-98-7
617696987
benzyl(2E)2((5(2chlorophenyl)furan2yl)methylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
benzyl(2E)2((5(2chlorophenyl)furan2yl)methylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
BENZYL2((5(2CHLOROPHENYL)FURAN2YL)METHYLENE)7METHYL3OXO5(THIOPHEN2YL)35DIHYDRO2HTHIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4Cl)SC2=N1)C5=CC=CS5)C(=O)OCC6=CC=CC=C6
Clc1ccccc1c1ccc(o1)C=c1sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OCc1ccccc1)C
InChI=1SC30H21ClN2O4S2c11826(29(35)3617198324919)27(24127153824)3328(34)25(3930(33)3218)1620131423(3720)2110561122(21)31h21627H17H21H3b2516+
MFCD04441542
ZINC000100871403
ZINC000100871404

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Available files

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