Vitas-M small molecule compound

methyl (2Z)-7-methyl-2-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK800347
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/1\c3ccccc3N(C1=O)C)/s2

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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 C27H25N3O4S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S/c1-14(2)16-10-12-17(13-11-16)22-20(26(33)34-5)15(3)28-27-30(22)25(32)23(35-27)21-18-8-6-7-9-19(18)29(4)24(21)31/h6-14,22H,1-5H3/b23-21-
InChIKey
NMJYBHVJQAZBCJ-LNVKXUELSA-N
Synonyms

CC1=C(C(N2C(=O)C(=C3C4=CC=CC=C4N(C3=O)C)SC2=N1)C5=CC=C(C=C5)C(C)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=C1c3ccccc3N(C1=O)C)s2
InChI=1SC27H25N3O4Sc114(2)16101217(131116)2220(26(33)345)15(3)282730(22)25(32)23(3527)2118867919(18)29(4)24(21)31h61422H15H3b2321
methyl(2Z)7methyl2(1methyl2oxo12dihydro3Hindol3ylidene)3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2Z)7methyl2(1methyl2oxoindol3ylidene)3oxo5(4propan2ylphenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD04447096
ZINC000016735658
ZINC000016735661

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Available files

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