Vitas-M small molecule compound
methyl 3-amino-6-methyl-4-(thiophen-2-yl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-4,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
Catalog ID
STK999146
SMILES COC(=O)C1=C(C)Nc2c(C1c1cccs1)c(N)c(s2)C(=O)C12CC3CC(C2)CC(C1)C3
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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 C25H28N2O3S2 MW 468.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O3S2/c1-12-17(24(29)30-2)18(16-4-3-5-31-16)19-20(26)21(32-23(19)27-12)22(28)25-9-13-6-14(10-25)8-15(7-13)11-25/h3-5,13-15,18,27H,6-11,26H2,1-2H3InChIKey
IREZVLDCPFDBDF-UHFFFAOYSA-NSynonyms
489443-78-9489443789
CC1=C(C(C2=C(N1)SC(=C2N)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CS6)C(=O)OC
InChI=1SC25H28N2O3S2c11217(24(29)302)18(164353116)1920(26)21(3223(19)2712)22(28)25913614(1025)815(713)1125h3513151827H61126H212H3
methyl2((1s3s)adamantane1carbonyl)3amino6methyl4(thiophen2yl)47dihydrothieno(23b)pyridine5carboxylate
METHYL2(1ADAMANTYLCARBONYL)3AMINO6METHYL4(2THIENYL)47DIHYDROTHIENO(23B)PYRIDINE5CARBOXYLATE
METHYL2(ADAMANTANE1CARBONYL)3AMINO6METHYL4THIOPHEN2YL47DIHYDROTHIENO(23B)PYRIDINE5CARBOXYLATE
METHYL2(ADAMANTANYLCARBONYL)3AMINO6METHYL4(2THIENYL)47DIHYDROTHIOPHENO(23B)PYRIDINE5CARBOXYLATE
methyl3amino6methyl4(thiophen2yl)2(tricyclo(3311~37~)dec1ylcarbonyl)47dihydrothieno(23b)pyridine5carboxylate
ZINC000008448508
ZINC000008448509
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