Vitas-M small molecule compound
N-[3-(methylsulfanyl)phenyl]-1,5-dioxo-4-(propan-2-yl)-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carboxamide
Catalog ID
STL423304
SMILES CSc1cccc(c1)NC(=O)C12CCC(=O)N2c2c(C(=O)N1C(C)C)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 C22H23N3O3S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3S/c1-14(2)24-20(27)17-9-4-5-10-18(17)25-19(26)11-12-22(24,25)21(28)23-15-7-6-8-16(13-15)29-3/h4-10,13-14H,11-12H2,1-3H3,(H,23,28)InChIKey
RRNHBXOTWFBSBK-UHFFFAOYSA-NSynonyms
1676051-80-11676051801
4isopropylN(3(methylthio)phenyl)15dioxo1233a45hexahydropyrrolo(12a)quinazoline3acarboxamide
CC(C)N1C(=O)C2=CC=CC=C2N3C1(CCC3=O)C(=O)NC4=CC(=CC=C4)SC
InChI=1SC22H23N3O3Sc114(2)2420(27)179451018(17)2519(26)111222(2425)21(28)231576816(1315)293h4101314H1112H213H3(H2328)
MFCD28986815
N(3(methylsulfanyl)phenyl)15dioxo4(propan2yl)2345tetrahydropyrrolo(12a)quinazoline3a(1H)carboxamide
N(3methylsulfanylphenyl)15dioxo4propan2yl23dihydropyrrolo(12a)quinazoline3acarboxamide
ZINC000218518126
ZINC000218518209
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