ethyl 1-[(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(5-amino-4-cyano-2-ethoxycarbonyl-3-thienyl)methyl]piperidine-3-carboxylate CAS Name: 1-[(5-amino-4-cyano-2-ethoxycarbonyl-3-thiophenyl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(5-amino-4-cyano-2-ethoxycarbonylthiophen-3-yl)methyl]piperidine-3-carboxylate Traditional Name: 1-[(5-amino-2-carbethoxy-4-cyano-3-thienyl)methyl]nipecotic acid ethyl ester Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)CC2=C(SC(=C2C#N)N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)CC2=C(SC(=C2C#N)N)C(=O)OCC

InChI

InChI=1S/C17H23N3O4S/c1-3-23-16(21)11-6-5-7-20(9-11)10-13-12(8-18)15(19)25-14(13)17(22)24-4-2/h11H,3-7,9-10,19H2,1-2H3