Vitas-M small molecule compound

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

Catalog ID
STK073407
SMILES CSc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)/c(=C/c1cccs1)/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 C23H22N2O3S3 MW 470.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O3S3/c1-13(2)28-22(27)19-14(3)24-23-25(20(19)15-7-9-16(29-4)10-8-15)21(26)18(31-23)12-17-6-5-11-30-17/h5-13,20H,1-4H3/b18-12-
InChIKey
BODQGOINRBYYSI-PDGQHHTCSA-N
Synonyms

CC1=C(C(N2C(=O)C(=CC3=CC=CS3)SC2=N1)C4=CC=C(C=C4)SC)C(=O)OC(C)C
CSc1ccc(cc1)C1C(=C(C)N=c2n1c(=O)c(=Cc1cccs1)s2)C(=O)OC(C)C
InChI=1SC23H22N2O3S3c113(2)2822(27)1914(3)242325(20(19)157916(294)10815)21(26)18(3123)121765113017h51320H14H3b1812
ISOPROPYL7METHYL5(4(METHYLSULFANYL)PHENYL)3OXO2(2THIENYLMETHYLENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03140281
PROPAN2YL(2Z)7METHYL5(4(METHYLSULFANYL)PHENYL)3OXO2(THIOPHEN2YLMETHYLIDENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
PROPAN2YL(2Z)7METHYL5(4METHYLSULFANYLPHENYL)3OXO2(THIOPHEN2YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
STK073407
ZINC000002183746
ZINC000002183748

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.