Vitas-M small molecule compound

methyl 3-[3-(diethylamino)propyl]-4-oxo-2-thioxo-1,2,3,4-tetrahydroquinazoline-7-carboxylate

Catalog ID
STK207433
SMILES CCN(CCCn1c(=S)[nH]c2c(c1=O)ccc(c2)C(=O)OC)CC

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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 C17H23N3O3S MW 349.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O3S/c1-4-19(5-2)9-6-10-20-15(21)13-8-7-12(16(22)23-3)11-14(13)18-17(20)24/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,24)
InChIKey
FBARBMLOSFUPQA-UHFFFAOYSA-N
Synonyms
422526-42-9
422526429
CCN(CC)CCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)NC1=S
CCN(CCCn1c(=S)(nH)c2c(c1=O)ccc(c2)C(=O)OC)CC
InChI=1SC17H23N3O3Sc1419(52)96102015(21)138712(16(22)233)1114(13)1817(20)24h7811H46910H213H3(H1824)
METHYL3(3(DIETHYLAMINO)PROPYL)4OXO2SULFANYLIDENE1HQUINAZOLINE7CARBOXYLATE
methyl3(3(diethylamino)propyl)4oxo2thioxo1234tetrahydroquinazoline7carboxylate
METHYL3(3(DIETHYLAMINO)PROPYL)4OXO2THIOXO13DIHYDROQUINAZOLINE7CARBOXYLATE
MFCD05024779
ZINC000019899379
ZINC19899379

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Available files

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