Vitas-M small molecule compound
propan-2-yl (2E)-2-[1-(2-chlorobenzyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK796773
SMILES COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/1\C(=O)N(c3c1cccc3)Cc1ccccc1Cl)/s2)C(=O)OC(C)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 C33H28ClN3O5S MW 614.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28ClN3O5S/c1-18(2)42-32(40)26-19(3)35-33-37(28(26)20-13-15-22(41-4)16-14-20)31(39)29(43-33)27-23-10-6-8-12-25(23)36(30(27)38)17-21-9-5-7-11-24(21)34/h5-16,18,28H,17H2,1-4H3/b29-27+InChIKey
QWZCMAQIAKENJR-ORIPQNMZSA-NSynonyms
CC1=C(C(N2C(=O)C(=C3C4=CC=CC=C4N(C3=O)CC5=CC=CC=C5Cl)SC2=N1)C6=CC=C(C=C6)OC)C(=O)OC(C)C
COc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=C1C(=O)N(c3c1cccc3)Cc1ccccc1Cl)s2)C(=O)OC(C)C
InChI=1SC33H28ClN3O5Sc118(2)4232(40)2619(3)353337(28(26)20131522(414)161420)31(39)29(4333)272310681225(23)36(30(27)38)17219571124(21)34h5161828H17H214H3b2927+
MFCD13372522
PROPAN2YL(2E)2(1((2CHLOROPHENYL)METHYL)2OXOINDOL3YLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
propan2yl(2E)2(1(2chlorobenzyl)2oxo12dihydro3Hindol3ylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000097968880
ZINC000097968881
Check stock
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Check stock on Vitas-MAvailable files
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