Vitas-M small molecule compound

4-({[3-(4-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}methyl)benzonitrile

Catalog ID
STL338662
SMILES N#Cc1ccc(cc1)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)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 C23H17N3OS MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3OS/c1-16-6-12-19(13-7-16)26-22(27)20-4-2-3-5-21(20)25-23(26)28-15-18-10-8-17(14-24)9-11-18/h2-13H,15H2,1H3
InChIKey
IOTIFFQLESBLSP-UHFFFAOYSA-N
Synonyms
476486-12-1
4(((3(4methylphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)methyl)benzonitrile
4(((4OXO3(PTOLYL)34DIHYDROQUINAZOLIN2YL)THIO)METHYL)BENZONITRILE
4((3(4METHYLPHENYL)4OXO3HYDROQUINAZOLIN2YLTHIO)METHYL)BENZENECARBONITRILE
4((3(4METHYLPHENYL)4OXOQUINAZOLIN2YL)SULFANYLMETHYL)BENZONITRILE
476486121
CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C#N
InChI=1SC23H17N3OSc11661219(13716)2622(27)20423521(20)2523(26)28151810817(1424)91118h213H15H21H3
MFCD03473965
ZINC000001088245
ZINC01088245
ZINC1088245

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Available files

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