ethyl 4-methyl-2-oxidanylidene-3-propyl-6-[3-(thiophen-2-ylcarbonylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-oxidanylidene-3-propyl-6-[3-(thiophen-2-ylcarbonylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-2-oxo-3-propyl-6-[3-(thiophene-2-carbonylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-oxo-3-propyl-6-[3-(thiophene-2-carbonylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-4-methyl-3-propyl-6-[3-(2-thenoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)OCC)C

InChI

InChI=1S/C22H25N3O4S/c1-4-11-25-14(3)18(21(27)29-5-2)19(24-22(25)28)15-8-6-9-16(13-15)23-20(26)17-10-7-12-30-17/h6-10,12-13,19H,4-5,11H2,1-3H3,(H,23,26)(H,24,28)