ethyl 3-ethyl-2-oxidanylidene-4-[(pyridin-2-ylamino)methyl]-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-ethyl-2-oxidanylidene-4-[(pyridin-2-ylamino)methyl]-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-2-oxo-4-[(2-pyridylamino)methyl]-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-2-oxo-4-[(2-pyridinylamino)methyl]-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-2-oxo-4-[(pyridin-2-ylamino)methyl]-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-2-keto-4-[(2-pyridylamino)methyl]-6-(3-thienyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CSC=C2)C(=O)OCC)CNC3=CC=CC=N3

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CSC=C2)C(=O)OCC)CNC3=CC=CC=N3

InChI

InChI=1S/C19H22N4O3S/c1-3-23-14(11-21-15-7-5-6-9-20-15)16(18(24)26-4-2)17(22-19(23)25)13-8-10-27-12-13/h5-10,12,17H,3-4,11H2,1-2H3,(H,20,21)(H,22,25)