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

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[4-(4-hydroxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-2-26-20(25)18-17(16(11-21)19(22)27-18)12-23-9-7-14(8-10-23)13-3-5-15(24)6-4-13/h3-7,24H,2,8-10,12,22H2,1H3