Vitas-M small molecule compound
ethyl (2Z)-5-(4-ethoxyphenyl)-7-methyl-3-oxo-2-{[1-(prop-2-en-1-yl)-1H-indol-3-yl]methylidene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL495669
SMILES C=CCn1cc(c2c1cccc2)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OCC)C(=O)OCC)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 C30H29N3O4S MW 527.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O4S/c1-5-16-32-18-21(23-10-8-9-11-24(23)32)17-25-28(34)33-27(20-12-14-22(15-13-20)36-6-2)26(29(35)37-7-3)19(4)31-30(33)38-25/h5,8-15,17-18,27H,1,6-7,16H2,2-4H3/b25-17-InChIKey
GKRSYOHBUKQODT-UQQQWYQISA-NSynonyms
C=CCn1cc(c2c1cccc2)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OCC)C(=O)OCC)C
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CN(C5=CC=CC=C54)CC=C)S3)C)C(=O)OCC
ethyl(2Z)5(4ethoxyphenyl)7methyl3oxo2((1(prop2en1yl)1Hindol3yl)methylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ETHOXYPHENYL)7METHYL3OXO2((1PROP2ENYLINDOL3YL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((1ALLYL1HINDOL3YL)METHYLENE)5(4ETHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H29N3O4Sc1516321821(2310891124(23)32)172528(34)3327(20121422(151320)3662)26(29(35)3773)19(4)3130(33)3825h5815171827H16716H224H3b2517
MFCD02070354
ZINC000002120574
ZINC000008451313
Check stock
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Check stock on Vitas-MAvailable files
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