(phenylmethyl) 6-(5-bromanylthiophen-2-yl)-3,4-dimethyl-2,6-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 6-(5-bromanylthiophen-2-yl)-3,4-dimethyl-2,6-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: benzyl 6-(5-bromo-2-thienyl)-3,4-dimethyl-2,6-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-(5-bromo-2-thiophenyl)-3,4-dimethyl-2,6-dihydro-1H-pyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(5-bromothiophen-2-yl)-3,4-dimethyl-2,6-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-(5-bromo-2-thienyl)-3,4-dimethyl-2,6-dihydro-1H-pyrimidine-5-carboxylic acid benzyl ester Formula: C18H19BrN2O2S MolecularWeight: 407.32466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NCN1C)C2=CC=C(S2)Br)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NCN1C)C2=CC=C(S2)Br)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H19BrN2O2S/c1-12-16(18(22)23-10-13-6-4-3-5-7-13)17(20-11-21(12)2)14-8-9-15(19)24-14/h3-9,17,20H,10-11H2,1-2H3