ethyl 4-azanyl-3-[[3-(cyclohexylcarbamoyl)phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxylate

Systemtic Name: ethyl 4-azanyl-3-[[3-(cyclohexylcarbamoyl)phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxylate Openeye Name: ethyl 4-amino-3-[[3-(cyclohexylcarbamoyl)phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxylate CAS Name: 4-amino-3-[[3-[(cyclohexylamino)-oxomethyl]phenoxy]methyl]-7-thieno[3,2-c]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-3-[[3-(cyclohexylcarbamoyl)phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxylate Traditional Name: 4-amino-3-[[3-(cyclohexylcarbamoyl)phenoxy]methyl]thieno[3,2-c]pyridine-7-carboxylic acid ethyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C2=C1SC=C2COC3=CC=CC(=C3)C(=O)NC4CCCCC4)N

Isomeric SMILES

CCOC(=O)C1=CN=C(C2=C1SC=C2COC3=CC=CC(=C3)C(=O)NC4CCCCC4)N

InChI

InChI=1S/C24H27N3O4S/c1-2-30-24(29)19-12-26-22(25)20-16(14-32-21(19)20)13-31-18-10-6-7-15(11-18)23(28)27-17-8-4-3-5-9-17/h6-7,10-12,14,17H,2-5,8-9,13H2,1H3,(H2,25,26)(H,27,28)