Vitas-M small molecule compound

methyl 4-oxo-2-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-3-phenyl-3,4-dihydroquinazoline-7-carboxylate

Catalog ID
STK149894
SMILES COC(=O)c1ccc2c(c1)nc(n(c2=O)c1ccccc1)SCC(=O)Nc1ccccc1

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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 C24H19N3O4S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N3O4S/c1-31-23(30)16-12-13-19-20(14-16)26-24(27(22(19)29)18-10-6-3-7-11-18)32-15-21(28)25-17-8-4-2-5-9-17/h2-14H,15H2,1H3,(H,25,28)
InChIKey
DSSCZKVFVSXSIU-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC24H19N3O4Sc13123(30)1612131920(1416)2624(27(22(19)29)18106371118)321521(28)25178425917h214H15H21H3(H2528)
METHYL2(2ANILINO2OXOETHYL)SULFANYL4OXO3PHENYLQUINAZOLINE7CARBOXYLATE
METHYL4OXO2((2OXO2(PHENYLAMINO)ETHYL)SULFANYL)3PHENYL34DIHYDROQUINAZOLINE7CARBOXYLATE
MFCD03778878
ZINC000002510519
ZINC02510519
ZINC2510519

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Available files

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