ethyl 2-oxidanylidene-6-[[[(R)-(4-propylphenyl)-thiophen-2-yl-methyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-6-[[[(R)-(4-propylphenyl)-thiophen-2-yl-methyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-oxo-6-[[[(R)-(4-propylphenyl)-(2-thienyl)methyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 2-oxo-6-[[[(R)-(4-propylphenyl)-thiophen-2-ylmethyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-6-[[[(R)-(4-propylphenyl)-thiophen-2-ylmethyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-[[[(R)-(4-propylphenyl)-(2-thienyl)methyl]amino]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NCC3=C(CNC(=O)N3)C(=O)OCC

Isomeric SMILES

CCCC1=CC=C(C=C1)[C@H](C2=CC=CS2)NCC3=C(CNC(=O)N3)C(=O)OCC

InChI

InChI=1S/C22H27N3O3S/c1-3-6-15-8-10-16(11-9-15)20(19-7-5-12-29-19)23-14-18-17(21(26)28-4-2)13-24-22(27)25-18/h5,7-12,20,23H,3-4,6,13-14H2,1-2H3,(H2,24,25,27)/t20-/m1/s1