Vitas-M small molecule compound
ethyl 3-[(3-chlorophenyl)carbamoyl]-2-{[(3-methylpiperidin-1-yl)acetyl]amino}-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Catalog ID
STK385226
SMILES CCOC(=O)N1CCc2c(C1)sc(c2C(=O)Nc1cccc(c1)Cl)NC(=O)CN1CCCC(C1)C
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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 C25H31ClN4O4S MW 519.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31ClN4O4S/c1-3-34-25(33)30-11-9-19-20(14-30)35-24(28-21(31)15-29-10-5-6-16(2)13-29)22(19)23(32)27-18-8-4-7-17(26)12-18/h4,7-8,12,16H,3,5-6,9-11,13-15H2,1-2H3,(H,27,32)(H,28,31)InChIKey
IXCCBQWCZCBQHE-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)Cl)NC(=O)CN4CCCC(C4)C
ETHYL3((3CHLOROPHENYL)CARBAMOYL)2(((3METHYLPIPERIDIN1YL)ACETYL)AMINO)47DIHYDROTHIENO(23C)PYRIDINE6(5H)CARBOXYLATE
ETHYL3((3CHLOROPHENYL)CARBAMOYL)2((2(3METHYLPIPERIDIN1YL)ACETYL)AMINO)57DIHYDRO4HTHIENO(23C)PYRIDINE6CARBOXYLATE
InChI=1SC25H31ClN4O4Sc133425(33)301191920(1430)3524(2821(31)1529105616(2)1329)22(19)23(32)271884717(26)1218h4781216H3569111315H212H3(H2732)(H2831)
MFCD03616487
ZINC000015946150
ZINC000015946152
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