Vitas-M small molecule compound
2-[2,5-dioxo-4-(thiophen-2-yl)-3,4,5,6,7,8-hexahydroquinolin-1(2H)-yl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carbonitrile
Catalog ID
STK780883
SMILES N#Cc1c(sc2c1CCCCC2)N1C(=O)CC(C2=C1CCCC2=O)c1cccs1
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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 C23H22N2O2S2 MW 422.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O2S2/c24-13-16-14-6-2-1-3-9-20(14)29-23(16)25-17-7-4-8-18(26)22(17)15(12-21(25)27)19-10-5-11-28-19/h5,10-11,15H,1-4,6-9,12H2InChIKey
IMDSMJURPQMSIS-UHFFFAOYSA-NSynonyms
2(25dioxo4(thiophen2yl)345678hexahydroquinolin1(2H)yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
2(25dioxo4thiophen2yl4678tetrahydro3Hquinolin1yl)5678tetrahydro4Hcyclohepta(b)thiophene3carbonitrile
C1CCC2=C(CC1)SC(=C2C#N)N3C4=C(C(CC3=O)C5=CC=CS5)C(=O)CCC4
InChI=1SC23H22N2O2S2c241316146213920(14)2923(16)251774818(26)22(17)15(1221(25)27)19105112819h5101115H146912H2
MFCD06013976
ZINC000001432335
ZINC000001432336
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