Vitas-M small molecule compound

2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(3-chloro-4-methylphenyl)acetamide

Catalog ID
STK010039
SMILES O=C(Nc1ccc(c(c1)Cl)C)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Br

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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 C23H17BrClN3O2S MW 514.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17BrClN3O2S/c1-14-6-9-16(12-19(14)25)26-21(29)13-31-23-27-20-5-3-2-4-18(20)22(30)28(23)17-10-7-15(24)8-11-17/h2-12H,13H2,1H3,(H,26,29)
InChIKey
BSWGVWOLQWTTDE-UHFFFAOYSA-N
Synonyms
499104-50-6
2((3(4BROMOPHENYL)4OXO34DIHYDROQUINAZOLIN2YL)SULFANYL)N(3CHLORO4METHYLPHENYL)ACETAMIDE
2((3(4bromophenyl)4oxo34dihydroquinazolin2yl)thio)N(3chloro4methylphenyl)acetamide
2(3(4BROMOPHENYL)4OXO(3HYDROQUINAZOLIN2YLTHIO))N(3CHLORO4METHYLPHENYL)ACETAMIDE
2(3(4BROMOPHENYL)4OXOQUINAZOLIN2YL)SULFANYLN(3CHLORO4METHYLPHENYL)ACETAMIDE
499104506
CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Br)Cl
InChI=1SC23H17BrClN3O2Sc1146916(1219(14)25)2621(29)1331232720532418(20)22(30)28(23)1710715(24)81117h212H13H21H3(H2629)
MFCD03474255
O=C(Nc1ccc(c(c1)Cl)C)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)Br
STK010039
ZINC000001833540
ZINC01833540
ZINC1833540

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Available files

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