ethyl 5-azanyl-4-cyano-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN2CCC(=CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CN2CCC(=CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O2S/c1-2-25-20(24)18-17(16(12-21)19(22)26-18)13-23-10-8-15(9-11-23)14-6-4-3-5-7-14/h3-8H,2,9-11,13,22H2,1H3