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

Systemtic Name: 2-methylpropyl 4-methyl-2-oxidanylidene-3-propyl-6-[3-(2-thiophen-2-ylethanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 4-methyl-2-oxo-3-propyl-6-[3-[[2-(2-thienyl)acetyl]amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-6-[3-[(1-oxo-2-thiophen-2-ylethyl)amino]phenyl]-3-propyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-methyl-2-oxo-3-propyl-6-[3-[(2-thiophen-2-ylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-4-methyl-3-propyl-6-[3-[[2-(2-thienyl)acetyl]amino]phenyl]-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CC3=CC=CS3)C(=O)OCC(C)C)C

Isomeric SMILES

CCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)CC3=CC=CS3)C(=O)OCC(C)C)C

InChI

InChI=1S/C25H31N3O4S/c1-5-11-28-17(4)22(24(30)32-15-16(2)3)23(27-25(28)31)18-8-6-9-19(13-18)26-21(29)14-20-10-7-12-33-20/h6-10,12-13,16,23H,5,11,14-15H2,1-4H3,(H,26,29)(H,27,31)