(phenylmethyl) 4-(3-iodanylphenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 4-(3-iodanylphenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate Openeye Name: benzyl 4-(3-iodophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate CAS Name: 4-(3-iodophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-iodophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate Traditional Name: 4-(3-iodophenyl)-6-methyl-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid benzyl ester Formula: C19H19IN2O2 MolecularWeight: 434.27083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NCN1)C2=CC(=CC=C2)I)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NCN1)C2=CC(=CC=C2)I)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H19IN2O2/c1-13-17(19(23)24-11-14-6-3-2-4-7-14)18(22-12-21-13)15-8-5-9-16(20)10-15/h2-10,18,21-22H,11-12H2,1H3