Vitas-M small molecule compound
ethyl 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
STK537506
SMILES CCOC(=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 C26H30N2O3S2 MW 482.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O3S2/c1-3-31-25(30)18-13(2)28-24-20(19(18)17-5-4-6-32-17)21(27)22(33-24)23(29)26-10-14-7-15(11-26)9-16(8-14)12-26/h4-6,14-16,19,28H,3,7-12,27H2,1-2H3InChIKey
SZAJDWNMYPXHQI-UHFFFAOYSA-NSynonyms
330181-13-0330181130
CCOC(=O)C1=C(NC2=C(C1C3=CC=CS3)C(=C(S2)C(=O)C45CC6CC(C4)CC(C6)C5)N)C
ethyl2((3r5r7r)adamantane1carbonyl)3amino6methyl4(thiophen2yl)47dihydrothieno(23b)pyridine5carboxylate
ETHYL2(ADAMANTANE1CARBONYL)3AMINO6METHYL4THIOPHEN2YL47DIHYDROTHIENO(23B)PYRIDINE5CARBOXYLATE
ethyl3amino6methyl4(thiophen2yl)2(tricyclo(3311~37~)dec1ylcarbonyl)47dihydrothieno(23b)pyridine5carboxylate
InChI=1SC26H30N2O3S2c133125(30)1813(2)282420(19(18)175463217)21(27)22(3324)23(29)261014715(1126)916(814)1226h4614161928H371227H212H3
MFCD01789319
ZINC000008965138
ZINC000008965139
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