Vitas-M small molecule compound
ethyl 2-[(azepan-1-ylacetyl)amino]-3-[(3-chlorophenyl)carbamoyl]-4,7-dihydrothieno[2,3-c]pyridine-6(5H)-carboxylate
Catalog ID
STK385227
SMILES CCOC(=O)N1CCc2c(C1)sc(c2C(=O)Nc1cccc(c1)Cl)NC(=O)CN1CCCCCC1
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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/c1-2-34-25(33)30-13-10-19-20(15-30)35-24(28-21(31)16-29-11-5-3-4-6-12-29)22(19)23(32)27-18-9-7-8-17(26)14-18/h7-9,14H,2-6,10-13,15-16H2,1H3,(H,27,32)(H,28,31)InChIKey
YVJBXMHIRPCHEL-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCC2=C(C1)SC(=C2C(=O)NC3=CC(=CC=C3)Cl)NC(=O)CN4CCCCCC4
ETHYL2((2(AZEPAN1YL)ACETYL)AMINO)3((3CHLOROPHENYL)CARBAMOYL)57DIHYDRO4HTHIENO(23C)PYRIDINE6CARBOXYLATE
ETHYL2((AZEPAN1YLACETYL)AMINO)3((3CHLOROPHENYL)CARBAMOYL)47DIHYDROTHIENO(23C)PYRIDINE6(5H)CARBOXYLATE
InChI=1SC25H31ClN4O4Sc123425(33)3013101920(1530)3524(2821(31)16291153461229)22(19)23(32)271897817(26)1418h7914H2610131516H21H3(H2732)(H2831)
MFCD03616488
ZINC000015946154
ZINC15946154
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