Vitas-M small molecule compound
4-ethyl-N-[3-(methylsulfanyl)phenyl]-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STL468569
SMILES CSc1cccc(c1)NC(=O)C12CCC(=O)N2c2c(C(=O)N1CC)cccc2
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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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-3-23-19(26)16-9-4-5-10-17(16)24-18(25)11-12-21(23,24)20(27)22-14-7-6-8-15(13-14)28-2/h4-10,13H,3,11-12H2,1-2H3,(H,22,27)InChIKey
CRVDTFHYWQPNPX-UHFFFAOYSA-NSynonyms
930899-38-0(R)4ethylN(3(methylthio)phenyl)15dioxo1233a45hexahydropyrrolo(12a)quinazoline3acarboxamide
4ethylN(3(methylsulfanyl)phenyl)15dioxo2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
4ethylN(3methylsulfanylphenyl)15dioxo23dihydropyrrolo(12a)quinazoline3acarboxamide
930899380
CCN1C(=O)C2=CC=CC=C2N3C1(CCC3=O)C(=O)NC4=CC(=CC=C4)SC
CSc1cccc(c1)NC(=O)(C@)12CCC(=O)N2c2c(C(=O)N1CC)cccc2
InChI=1SC21H21N3O3Sc132319(26)169451017(16)2418(25)111221(2324)20(27)221476815(1314)282h41013H31112H212H3(H2227)
MFCD09336584
ZINC000008728929
ZINC000008728930
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