Vitas-M small molecule compound
methyl (2Z)-2-[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL397270
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1c(C)nn(c1Cl)c1ccccc1)/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 C26H21ClN4O3S MW 505.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN4O3S/c1-15-19(23(27)31(29-15)18-12-8-5-9-13-18)14-20-24(32)30-22(17-10-6-4-7-11-17)21(25(33)34-3)16(2)28-26(30)35-20/h4-14,22H,1-3H3/b20-14-InChIKey
BZKBQPSLCXJGDW-ZHZULCJRSA-NSynonyms
515861-18-4515861184
CC1=C(C(N2C(=O)C(=CC3=C(N(N=C3C)C4=CC=CC=C4)Cl)SC2=N1)C5=CC=CC=C5)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1c(C)nn(c1Cl)c1ccccc1)s2
InChI=1SC26H21ClN4O3Sc11519(23(27)31(2915)18128591318)142024(32)3022(17106471117)21(25(33)343)16(2)2826(30)3520h41422H13H3b2014
METHYL(2Z)2((5CHLORO3METHYL1PHENYL1HPYRAZOL4YL)METHYLIDENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL(2Z)2((5CHLORO3METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL2((5CHLORO3METHYL1PHENYL1HPYRAZOL4YL)METHYLENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03759402
ZINC000000651594
ZINC000000651599
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