Vitas-M small molecule compound
(2E)-6-acetyl-2-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-(2,4-dimethoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Catalog ID
STK675259
SMILES COc1cc(OC)ccc1C1C(=C(C)N=c2n1c(=O)/c(=C\c1cc(n(c1C)c1ccc(cc1)Cl)C)/s2)C(=O)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 C30H28ClN3O4S MW 562.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28ClN3O4S/c1-16-13-20(18(3)33(16)22-9-7-21(31)8-10-22)14-26-29(36)34-28(24-12-11-23(37-5)15-25(24)38-6)27(19(4)35)17(2)32-30(34)39-26/h7-15,28H,1-6H3/b26-14+InChIKey
ZOUPJVPFCVMUOB-VULFUBBASA-NSynonyms
(2E)6acetyl2((1(4chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5(24dimethoxyphenyl)7methyl5H(13)thiazolo(32a)pyrimidin3(2H)one
(2E)6ACETYL2((1(4CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)5(24DIMETHOXYPHENYL)7METHYL5H(13)THIAZOLO(32A)PYRIMIDIN3ONE
CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)C)C5=C(C=C(C=C5)OC)OC
COc1cc(OC)ccc1C1C(=C(C)N=c2n1c(=O)c(=Cc1cc(n(c1C)c1ccc(cc1)Cl)C)s2)C(=O)C
InChI=1SC30H28ClN3O4Sc1161320(18(3)33(16)229721(31)81022)142629(36)3428(24121123(375)1525(24)386)27(19(4)35)17(2)3230(34)3926h71528H16H3b2614+
MFCD01571762
ZINC000001062997
ZINC000100076739
Check stock
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Check stock on Vitas-MAvailable files
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